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| 22 | <title>Help for GSAS-II</title> |
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| 25 | <o:Author>Von Dreele</o:Author> |
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| 26 | <o:LastAuthor>Von Dreele</o:LastAuthor> |
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| 27 | <o:Revision>93</o:Revision> |
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| 28 | <o:TotalTime>2865</o:TotalTime> |
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| 29 | <o:Created>2011-11-28T16:49:00Z</o:Created> |
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| 34 | <o:Company>Argonne National Laboratory</o:Company> |
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|---|
| 307 | UnhideWhenUsed="false" Name="Light List Accent 6"/> |
|---|
| 308 | <w:LsdException Locked="false" Priority="62" SemiHidden="false" |
|---|
| 309 | UnhideWhenUsed="false" Name="Light Grid Accent 6"/> |
|---|
| 310 | <w:LsdException Locked="false" Priority="63" SemiHidden="false" |
|---|
| 311 | UnhideWhenUsed="false" Name="Medium Shading 1 Accent 6"/> |
|---|
| 312 | <w:LsdException Locked="false" Priority="64" SemiHidden="false" |
|---|
| 313 | UnhideWhenUsed="false" Name="Medium Shading 2 Accent 6"/> |
|---|
| 314 | <w:LsdException Locked="false" Priority="65" SemiHidden="false" |
|---|
| 315 | UnhideWhenUsed="false" Name="Medium List 1 Accent 6"/> |
|---|
| 316 | <w:LsdException Locked="false" Priority="66" SemiHidden="false" |
|---|
| 317 | UnhideWhenUsed="false" Name="Medium List 2 Accent 6"/> |
|---|
| 318 | <w:LsdException Locked="false" Priority="67" SemiHidden="false" |
|---|
| 319 | UnhideWhenUsed="false" Name="Medium Grid 1 Accent 6"/> |
|---|
| 320 | <w:LsdException Locked="false" Priority="68" SemiHidden="false" |
|---|
| 321 | UnhideWhenUsed="false" Name="Medium Grid 2 Accent 6"/> |
|---|
| 322 | <w:LsdException Locked="false" Priority="69" SemiHidden="false" |
|---|
| 323 | UnhideWhenUsed="false" Name="Medium Grid 3 Accent 6"/> |
|---|
| 324 | <w:LsdException Locked="false" Priority="70" SemiHidden="false" |
|---|
| 325 | UnhideWhenUsed="false" Name="Dark List Accent 6"/> |
|---|
| 326 | <w:LsdException Locked="false" Priority="71" SemiHidden="false" |
|---|
| 327 | UnhideWhenUsed="false" Name="Colorful Shading Accent 6"/> |
|---|
| 328 | <w:LsdException Locked="false" Priority="72" SemiHidden="false" |
|---|
| 329 | UnhideWhenUsed="false" Name="Colorful List Accent 6"/> |
|---|
| 330 | <w:LsdException Locked="false" Priority="73" SemiHidden="false" |
|---|
| 331 | UnhideWhenUsed="false" Name="Colorful Grid Accent 6"/> |
|---|
| 332 | <w:LsdException Locked="false" Priority="19" SemiHidden="false" |
|---|
| 333 | UnhideWhenUsed="false" QFormat="true" Name="Subtle Emphasis"/> |
|---|
| 334 | <w:LsdException Locked="false" Priority="21" SemiHidden="false" |
|---|
| 335 | UnhideWhenUsed="false" QFormat="true" Name="Intense Emphasis"/> |
|---|
| 336 | <w:LsdException Locked="false" Priority="31" SemiHidden="false" |
|---|
| 337 | UnhideWhenUsed="false" QFormat="true" Name="Subtle Reference"/> |
|---|
| 338 | <w:LsdException Locked="false" Priority="32" SemiHidden="false" |
|---|
| 339 | UnhideWhenUsed="false" QFormat="true" Name="Intense Reference"/> |
|---|
| 340 | <w:LsdException Locked="false" Priority="33" SemiHidden="false" |
|---|
| 341 | UnhideWhenUsed="false" QFormat="true" Name="Book Title"/> |
|---|
| 342 | <w:LsdException Locked="false" Priority="37" Name="Bibliography"/> |
|---|
| 343 | <w:LsdException Locked="false" Priority="39" QFormat="true" Name="TOC Heading"/> |
|---|
| 344 | </w:LatentStyles> |
|---|
| 345 | </xml><![endif]--> |
|---|
| 346 | <style> |
|---|
| 347 | <!-- |
|---|
| 348 | /* Font Definitions */ |
|---|
| 349 | @font-face |
|---|
| 350 | {font-family:"Cambria Math"; |
|---|
| 351 | panose-1:2 4 5 3 5 4 6 3 2 4; |
|---|
| 352 | mso-font-charset:0; |
|---|
| 353 | mso-generic-font-family:roman; |
|---|
| 354 | mso-font-pitch:variable; |
|---|
| 355 | mso-font-signature:-536870145 1107305727 0 0 415 0;} |
|---|
| 356 | @font-face |
|---|
| 357 | {font-family:Cambria; |
|---|
| 358 | panose-1:2 4 5 3 5 4 6 3 2 4; |
|---|
| 359 | mso-font-charset:0; |
|---|
| 360 | mso-generic-font-family:roman; |
|---|
| 361 | mso-font-pitch:variable; |
|---|
| 362 | mso-font-signature:-536870145 1073743103 0 0 415 0;} |
|---|
| 363 | @font-face |
|---|
| 364 | {font-family:Tahoma; |
|---|
| 365 | panose-1:2 11 6 4 3 5 4 4 2 4; |
|---|
| 366 | mso-font-charset:0; |
|---|
| 367 | mso-generic-font-family:swiss; |
|---|
| 368 | mso-font-pitch:variable; |
|---|
| 369 | mso-font-signature:-520081665 -1073717157 41 0 66047 0;} |
|---|
| 370 | /* Style Definitions */ |
|---|
| 371 | p.MsoNormal, li.MsoNormal, div.MsoNormal |
|---|
| 372 | {mso-style-unhide:no; |
|---|
| 373 | mso-style-qformat:yes; |
|---|
| 374 | mso-style-parent:""; |
|---|
| 375 | margin:0in; |
|---|
| 376 | margin-bottom:.0001pt; |
|---|
| 377 | mso-pagination:widow-orphan; |
|---|
| 378 | font-size:12.0pt; |
|---|
| 379 | font-family:"Times New Roman","serif"; |
|---|
| 380 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 381 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 382 | h1 |
|---|
| 383 | {mso-style-priority:9; |
|---|
| 384 | mso-style-unhide:no; |
|---|
| 385 | mso-style-qformat:yes; |
|---|
| 386 | mso-style-link:"Heading 1 Char"; |
|---|
| 387 | mso-margin-top-alt:auto; |
|---|
| 388 | margin-right:0in; |
|---|
| 389 | mso-margin-bottom-alt:auto; |
|---|
| 390 | margin-left:0in; |
|---|
| 391 | mso-pagination:widow-orphan; |
|---|
| 392 | mso-outline-level:1; |
|---|
| 393 | font-size:24.0pt; |
|---|
| 394 | font-family:"Times New Roman","serif"; |
|---|
| 395 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 396 | mso-fareast-theme-font:minor-fareast; |
|---|
| 397 | font-weight:bold;} |
|---|
| 398 | h2 |
|---|
| 399 | {mso-style-priority:9; |
|---|
| 400 | mso-style-unhide:no; |
|---|
| 401 | mso-style-qformat:yes; |
|---|
| 402 | mso-style-link:"Heading 2 Char"; |
|---|
| 403 | mso-margin-top-alt:auto; |
|---|
| 404 | margin-right:0in; |
|---|
| 405 | mso-margin-bottom-alt:auto; |
|---|
| 406 | margin-left:0in; |
|---|
| 407 | mso-pagination:widow-orphan; |
|---|
| 408 | mso-outline-level:2; |
|---|
| 409 | font-size:18.0pt; |
|---|
| 410 | font-family:"Times New Roman","serif"; |
|---|
| 411 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 412 | mso-fareast-theme-font:minor-fareast; |
|---|
| 413 | font-weight:bold;} |
|---|
| 414 | h3 |
|---|
| 415 | {mso-style-priority:9; |
|---|
| 416 | mso-style-unhide:no; |
|---|
| 417 | mso-style-qformat:yes; |
|---|
| 418 | mso-style-link:"Heading 3 Char"; |
|---|
| 419 | mso-margin-top-alt:auto; |
|---|
| 420 | margin-right:0in; |
|---|
| 421 | mso-margin-bottom-alt:auto; |
|---|
| 422 | margin-left:0in; |
|---|
| 423 | mso-pagination:widow-orphan; |
|---|
| 424 | mso-outline-level:3; |
|---|
| 425 | font-size:13.5pt; |
|---|
| 426 | font-family:"Times New Roman","serif"; |
|---|
| 427 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 428 | mso-fareast-theme-font:minor-fareast; |
|---|
| 429 | font-weight:bold;} |
|---|
| 430 | h4 |
|---|
| 431 | {mso-style-noshow:yes; |
|---|
| 432 | mso-style-priority:9; |
|---|
| 433 | mso-style-qformat:yes; |
|---|
| 434 | mso-style-link:"Heading 4 Char"; |
|---|
| 435 | mso-style-next:Normal; |
|---|
| 436 | margin-top:10.0pt; |
|---|
| 437 | margin-right:0in; |
|---|
| 438 | margin-bottom:0in; |
|---|
| 439 | margin-left:0in; |
|---|
| 440 | margin-bottom:.0001pt; |
|---|
| 441 | mso-pagination:widow-orphan lines-together; |
|---|
| 442 | page-break-after:avoid; |
|---|
| 443 | mso-outline-level:4; |
|---|
| 444 | font-size:13.0pt; |
|---|
| 445 | font-family:"Cambria","serif"; |
|---|
| 446 | mso-ascii-font-family:Cambria; |
|---|
| 447 | mso-ascii-theme-font:major-latin; |
|---|
| 448 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 449 | mso-fareast-theme-font:major-fareast; |
|---|
| 450 | mso-hansi-font-family:Cambria; |
|---|
| 451 | mso-hansi-theme-font:major-latin; |
|---|
| 452 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 453 | mso-bidi-theme-font:major-bidi; |
|---|
| 454 | color:#4F81BD; |
|---|
| 455 | mso-themecolor:accent1; |
|---|
| 456 | font-weight:bold; |
|---|
| 457 | font-style:italic;} |
|---|
| 458 | h5 |
|---|
| 459 | {mso-style-noshow:yes; |
|---|
| 460 | mso-style-priority:9; |
|---|
| 461 | mso-style-qformat:yes; |
|---|
| 462 | mso-style-link:"Heading 5 Char"; |
|---|
| 463 | mso-margin-top-alt:auto; |
|---|
| 464 | margin-right:0in; |
|---|
| 465 | mso-margin-bottom-alt:auto; |
|---|
| 466 | margin-left:0in; |
|---|
| 467 | mso-pagination:widow-orphan; |
|---|
| 468 | mso-outline-level:5; |
|---|
| 469 | font-size:12.0pt; |
|---|
| 470 | font-family:"Times New Roman","serif"; |
|---|
| 471 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 472 | mso-fareast-theme-font:minor-fareast; |
|---|
| 473 | color:#4F4FFF; |
|---|
| 474 | font-weight:bold;} |
|---|
| 475 | p.MsoTitle, li.MsoTitle, div.MsoTitle |
|---|
| 476 | {mso-style-noshow:yes; |
|---|
| 477 | mso-style-priority:10; |
|---|
| 478 | mso-style-unhide:no; |
|---|
| 479 | mso-style-qformat:yes; |
|---|
| 480 | mso-style-link:"Title Char"; |
|---|
| 481 | mso-style-next:Normal; |
|---|
| 482 | margin-top:0in; |
|---|
| 483 | margin-right:0in; |
|---|
| 484 | margin-bottom:15.0pt; |
|---|
| 485 | margin-left:0in; |
|---|
| 486 | mso-add-space:auto; |
|---|
| 487 | mso-pagination:widow-orphan; |
|---|
| 488 | border:none; |
|---|
| 489 | mso-border-bottom-alt:solid #4F81BD 1.0pt; |
|---|
| 490 | mso-border-bottom-themecolor:accent1; |
|---|
| 491 | padding:0in; |
|---|
| 492 | mso-padding-alt:0in 0in 4.0pt 0in; |
|---|
| 493 | font-size:26.0pt; |
|---|
| 494 | font-family:"Cambria","serif"; |
|---|
| 495 | mso-ascii-font-family:Cambria; |
|---|
| 496 | mso-ascii-theme-font:major-latin; |
|---|
| 497 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 498 | mso-fareast-theme-font:major-fareast; |
|---|
| 499 | mso-hansi-font-family:Cambria; |
|---|
| 500 | mso-hansi-theme-font:major-latin; |
|---|
| 501 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 502 | mso-bidi-theme-font:major-bidi; |
|---|
| 503 | color:#17365D; |
|---|
| 504 | mso-themecolor:text2; |
|---|
| 505 | mso-themeshade:191; |
|---|
| 506 | letter-spacing:.25pt; |
|---|
| 507 | mso-font-kerning:14.0pt;} |
|---|
| 508 | p.MsoTitleCxSpFirst, li.MsoTitleCxSpFirst, div.MsoTitleCxSpFirst |
|---|
| 509 | {mso-style-noshow:yes; |
|---|
| 510 | mso-style-priority:10; |
|---|
| 511 | mso-style-unhide:no; |
|---|
| 512 | mso-style-qformat:yes; |
|---|
| 513 | mso-style-link:"Title Char"; |
|---|
| 514 | mso-style-next:Normal; |
|---|
| 515 | mso-style-type:export-only; |
|---|
| 516 | margin:0in; |
|---|
| 517 | margin-bottom:.0001pt; |
|---|
| 518 | mso-add-space:auto; |
|---|
| 519 | mso-pagination:widow-orphan; |
|---|
| 520 | border:none; |
|---|
| 521 | mso-border-bottom-alt:solid #4F81BD 1.0pt; |
|---|
| 522 | mso-border-bottom-themecolor:accent1; |
|---|
| 523 | padding:0in; |
|---|
| 524 | mso-padding-alt:0in 0in 4.0pt 0in; |
|---|
| 525 | font-size:26.0pt; |
|---|
| 526 | font-family:"Cambria","serif"; |
|---|
| 527 | mso-ascii-font-family:Cambria; |
|---|
| 528 | mso-ascii-theme-font:major-latin; |
|---|
| 529 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 530 | mso-fareast-theme-font:major-fareast; |
|---|
| 531 | mso-hansi-font-family:Cambria; |
|---|
| 532 | mso-hansi-theme-font:major-latin; |
|---|
| 533 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 534 | mso-bidi-theme-font:major-bidi; |
|---|
| 535 | color:#17365D; |
|---|
| 536 | mso-themecolor:text2; |
|---|
| 537 | mso-themeshade:191; |
|---|
| 538 | letter-spacing:.25pt; |
|---|
| 539 | mso-font-kerning:14.0pt;} |
|---|
| 540 | p.MsoTitleCxSpMiddle, li.MsoTitleCxSpMiddle, div.MsoTitleCxSpMiddle |
|---|
| 541 | {mso-style-noshow:yes; |
|---|
| 542 | mso-style-priority:10; |
|---|
| 543 | mso-style-unhide:no; |
|---|
| 544 | mso-style-qformat:yes; |
|---|
| 545 | mso-style-link:"Title Char"; |
|---|
| 546 | mso-style-next:Normal; |
|---|
| 547 | mso-style-type:export-only; |
|---|
| 548 | margin:0in; |
|---|
| 549 | margin-bottom:.0001pt; |
|---|
| 550 | mso-add-space:auto; |
|---|
| 551 | mso-pagination:widow-orphan; |
|---|
| 552 | border:none; |
|---|
| 553 | mso-border-bottom-alt:solid #4F81BD 1.0pt; |
|---|
| 554 | mso-border-bottom-themecolor:accent1; |
|---|
| 555 | padding:0in; |
|---|
| 556 | mso-padding-alt:0in 0in 4.0pt 0in; |
|---|
| 557 | font-size:26.0pt; |
|---|
| 558 | font-family:"Cambria","serif"; |
|---|
| 559 | mso-ascii-font-family:Cambria; |
|---|
| 560 | mso-ascii-theme-font:major-latin; |
|---|
| 561 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 562 | mso-fareast-theme-font:major-fareast; |
|---|
| 563 | mso-hansi-font-family:Cambria; |
|---|
| 564 | mso-hansi-theme-font:major-latin; |
|---|
| 565 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 566 | mso-bidi-theme-font:major-bidi; |
|---|
| 567 | color:#17365D; |
|---|
| 568 | mso-themecolor:text2; |
|---|
| 569 | mso-themeshade:191; |
|---|
| 570 | letter-spacing:.25pt; |
|---|
| 571 | mso-font-kerning:14.0pt;} |
|---|
| 572 | p.MsoTitleCxSpLast, li.MsoTitleCxSpLast, div.MsoTitleCxSpLast |
|---|
| 573 | {mso-style-noshow:yes; |
|---|
| 574 | mso-style-priority:10; |
|---|
| 575 | mso-style-unhide:no; |
|---|
| 576 | mso-style-qformat:yes; |
|---|
| 577 | mso-style-link:"Title Char"; |
|---|
| 578 | mso-style-next:Normal; |
|---|
| 579 | mso-style-type:export-only; |
|---|
| 580 | margin-top:0in; |
|---|
| 581 | margin-right:0in; |
|---|
| 582 | margin-bottom:15.0pt; |
|---|
| 583 | margin-left:0in; |
|---|
| 584 | mso-add-space:auto; |
|---|
| 585 | mso-pagination:widow-orphan; |
|---|
| 586 | border:none; |
|---|
| 587 | mso-border-bottom-alt:solid #4F81BD 1.0pt; |
|---|
| 588 | mso-border-bottom-themecolor:accent1; |
|---|
| 589 | padding:0in; |
|---|
| 590 | mso-padding-alt:0in 0in 4.0pt 0in; |
|---|
| 591 | font-size:26.0pt; |
|---|
| 592 | font-family:"Cambria","serif"; |
|---|
| 593 | mso-ascii-font-family:Cambria; |
|---|
| 594 | mso-ascii-theme-font:major-latin; |
|---|
| 595 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 596 | mso-fareast-theme-font:major-fareast; |
|---|
| 597 | mso-hansi-font-family:Cambria; |
|---|
| 598 | mso-hansi-theme-font:major-latin; |
|---|
| 599 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 600 | mso-bidi-theme-font:major-bidi; |
|---|
| 601 | color:#17365D; |
|---|
| 602 | mso-themecolor:text2; |
|---|
| 603 | mso-themeshade:191; |
|---|
| 604 | letter-spacing:.25pt; |
|---|
| 605 | mso-font-kerning:14.0pt;} |
|---|
| 606 | a:link, span.MsoHyperlink |
|---|
| 607 | {mso-style-priority:99; |
|---|
| 608 | color:blue; |
|---|
| 609 | text-decoration:underline; |
|---|
| 610 | text-underline:single;} |
|---|
| 611 | a:visited, span.MsoHyperlinkFollowed |
|---|
| 612 | {mso-style-noshow:yes; |
|---|
| 613 | mso-style-priority:99; |
|---|
| 614 | color:purple; |
|---|
| 615 | text-decoration:underline; |
|---|
| 616 | text-underline:single;} |
|---|
| 617 | p.MsoDocumentMap, li.MsoDocumentMap, div.MsoDocumentMap |
|---|
| 618 | {mso-style-noshow:yes; |
|---|
| 619 | mso-style-priority:99; |
|---|
| 620 | mso-style-link:"Document Map Char"; |
|---|
| 621 | margin:0in; |
|---|
| 622 | margin-bottom:.0001pt; |
|---|
| 623 | mso-pagination:widow-orphan; |
|---|
| 624 | font-size:8.0pt; |
|---|
| 625 | font-family:"Tahoma","sans-serif"; |
|---|
| 626 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 627 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 628 | p |
|---|
| 629 | {mso-style-noshow:yes; |
|---|
| 630 | mso-style-priority:99; |
|---|
| 631 | mso-margin-top-alt:auto; |
|---|
| 632 | margin-right:0in; |
|---|
| 633 | mso-margin-bottom-alt:auto; |
|---|
| 634 | margin-left:0in; |
|---|
| 635 | mso-pagination:widow-orphan; |
|---|
| 636 | font-size:12.0pt; |
|---|
| 637 | font-family:"Times New Roman","serif"; |
|---|
| 638 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 639 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 640 | pre |
|---|
| 641 | {mso-style-noshow:yes; |
|---|
| 642 | mso-style-priority:99; |
|---|
| 643 | mso-style-link:"HTML Preformatted Char"; |
|---|
| 644 | margin:0in; |
|---|
| 645 | margin-bottom:.0001pt; |
|---|
| 646 | mso-pagination:widow-orphan; |
|---|
| 647 | tab-stops:45.8pt 91.6pt 137.4pt 183.2pt 229.0pt 274.8pt 320.6pt 366.4pt 412.2pt 458.0pt 503.8pt 549.6pt 595.4pt 641.2pt 687.0pt 732.8pt; |
|---|
| 648 | font-size:10.0pt; |
|---|
| 649 | font-family:"Courier New"; |
|---|
| 650 | mso-fareast-font-family:"Times New Roman";} |
|---|
| 651 | p.MsoAcetate, li.MsoAcetate, div.MsoAcetate |
|---|
| 652 | {mso-style-noshow:yes; |
|---|
| 653 | mso-style-priority:99; |
|---|
| 654 | mso-style-link:"Balloon Text Char"; |
|---|
| 655 | margin:0in; |
|---|
| 656 | margin-bottom:.0001pt; |
|---|
| 657 | mso-pagination:widow-orphan; |
|---|
| 658 | font-size:8.0pt; |
|---|
| 659 | font-family:"Tahoma","sans-serif"; |
|---|
| 660 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 661 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 662 | span.MsoPlaceholderText |
|---|
| 663 | {mso-style-noshow:yes; |
|---|
| 664 | mso-style-priority:99; |
|---|
| 665 | mso-style-unhide:no; |
|---|
| 666 | color:gray;} |
|---|
| 667 | p.MsoNoSpacing, li.MsoNoSpacing, div.MsoNoSpacing |
|---|
| 668 | {mso-style-noshow:yes; |
|---|
| 669 | mso-style-priority:1; |
|---|
| 670 | mso-style-unhide:no; |
|---|
| 671 | mso-style-qformat:yes; |
|---|
| 672 | mso-style-parent:""; |
|---|
| 673 | margin:0in; |
|---|
| 674 | margin-bottom:.0001pt; |
|---|
| 675 | mso-pagination:widow-orphan; |
|---|
| 676 | font-size:12.0pt; |
|---|
| 677 | font-family:"Times New Roman","serif"; |
|---|
| 678 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 679 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 680 | p.MsoListParagraph, li.MsoListParagraph, div.MsoListParagraph |
|---|
| 681 | {mso-style-noshow:yes; |
|---|
| 682 | mso-style-priority:34; |
|---|
| 683 | mso-style-unhide:no; |
|---|
| 684 | mso-style-qformat:yes; |
|---|
| 685 | margin-top:0in; |
|---|
| 686 | margin-right:0in; |
|---|
| 687 | margin-bottom:0in; |
|---|
| 688 | margin-left:.5in; |
|---|
| 689 | margin-bottom:.0001pt; |
|---|
| 690 | mso-add-space:auto; |
|---|
| 691 | mso-pagination:widow-orphan; |
|---|
| 692 | font-size:12.0pt; |
|---|
| 693 | font-family:"Times New Roman","serif"; |
|---|
| 694 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 695 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 696 | p.MsoListParagraphCxSpFirst, li.MsoListParagraphCxSpFirst, div.MsoListParagraphCxSpFirst |
|---|
| 697 | {mso-style-noshow:yes; |
|---|
| 698 | mso-style-priority:34; |
|---|
| 699 | mso-style-unhide:no; |
|---|
| 700 | mso-style-qformat:yes; |
|---|
| 701 | mso-style-type:export-only; |
|---|
| 702 | margin-top:0in; |
|---|
| 703 | margin-right:0in; |
|---|
| 704 | margin-bottom:0in; |
|---|
| 705 | margin-left:.5in; |
|---|
| 706 | margin-bottom:.0001pt; |
|---|
| 707 | mso-add-space:auto; |
|---|
| 708 | mso-pagination:widow-orphan; |
|---|
| 709 | font-size:12.0pt; |
|---|
| 710 | font-family:"Times New Roman","serif"; |
|---|
| 711 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 712 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 713 | p.MsoListParagraphCxSpMiddle, li.MsoListParagraphCxSpMiddle, div.MsoListParagraphCxSpMiddle |
|---|
| 714 | {mso-style-noshow:yes; |
|---|
| 715 | mso-style-priority:34; |
|---|
| 716 | mso-style-unhide:no; |
|---|
| 717 | mso-style-qformat:yes; |
|---|
| 718 | mso-style-type:export-only; |
|---|
| 719 | margin-top:0in; |
|---|
| 720 | margin-right:0in; |
|---|
| 721 | margin-bottom:0in; |
|---|
| 722 | margin-left:.5in; |
|---|
| 723 | margin-bottom:.0001pt; |
|---|
| 724 | mso-add-space:auto; |
|---|
| 725 | mso-pagination:widow-orphan; |
|---|
| 726 | font-size:12.0pt; |
|---|
| 727 | font-family:"Times New Roman","serif"; |
|---|
| 728 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 729 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 730 | p.MsoListParagraphCxSpLast, li.MsoListParagraphCxSpLast, div.MsoListParagraphCxSpLast |
|---|
| 731 | {mso-style-noshow:yes; |
|---|
| 732 | mso-style-priority:34; |
|---|
| 733 | mso-style-unhide:no; |
|---|
| 734 | mso-style-qformat:yes; |
|---|
| 735 | mso-style-type:export-only; |
|---|
| 736 | margin-top:0in; |
|---|
| 737 | margin-right:0in; |
|---|
| 738 | margin-bottom:0in; |
|---|
| 739 | margin-left:.5in; |
|---|
| 740 | margin-bottom:.0001pt; |
|---|
| 741 | mso-add-space:auto; |
|---|
| 742 | mso-pagination:widow-orphan; |
|---|
| 743 | font-size:12.0pt; |
|---|
| 744 | font-family:"Times New Roman","serif"; |
|---|
| 745 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 746 | mso-fareast-theme-font:minor-fareast;} |
|---|
| 747 | span.MsoIntenseReference |
|---|
| 748 | {mso-style-priority:32; |
|---|
| 749 | mso-style-unhide:no; |
|---|
| 750 | mso-style-qformat:yes; |
|---|
| 751 | font-variant:small-caps; |
|---|
| 752 | color:#C0504D; |
|---|
| 753 | mso-themecolor:accent2; |
|---|
| 754 | letter-spacing:.25pt; |
|---|
| 755 | font-weight:bold; |
|---|
| 756 | text-decoration:underline; |
|---|
| 757 | text-underline:single;} |
|---|
| 758 | span.Heading1Char |
|---|
| 759 | {mso-style-name:"Heading 1 Char"; |
|---|
| 760 | mso-style-priority:9; |
|---|
| 761 | mso-style-unhide:no; |
|---|
| 762 | mso-style-locked:yes; |
|---|
| 763 | mso-style-link:"Heading 1"; |
|---|
| 764 | mso-ansi-font-size:14.0pt; |
|---|
| 765 | mso-bidi-font-size:14.0pt; |
|---|
| 766 | font-family:"Cambria","serif"; |
|---|
| 767 | mso-ascii-font-family:Cambria; |
|---|
| 768 | mso-ascii-theme-font:major-latin; |
|---|
| 769 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 770 | mso-fareast-theme-font:major-fareast; |
|---|
| 771 | mso-hansi-font-family:Cambria; |
|---|
| 772 | mso-hansi-theme-font:major-latin; |
|---|
| 773 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 774 | mso-bidi-theme-font:major-bidi; |
|---|
| 775 | color:#365F91; |
|---|
| 776 | mso-themecolor:accent1; |
|---|
| 777 | mso-themeshade:191; |
|---|
| 778 | font-weight:bold;} |
|---|
| 779 | span.Heading2Char |
|---|
| 780 | {mso-style-name:"Heading 2 Char"; |
|---|
| 781 | mso-style-noshow:yes; |
|---|
| 782 | mso-style-priority:9; |
|---|
| 783 | mso-style-unhide:no; |
|---|
| 784 | mso-style-locked:yes; |
|---|
| 785 | mso-style-link:"Heading 2"; |
|---|
| 786 | mso-ansi-font-size:13.0pt; |
|---|
| 787 | mso-bidi-font-size:13.0pt; |
|---|
| 788 | font-family:"Cambria","serif"; |
|---|
| 789 | mso-ascii-font-family:Cambria; |
|---|
| 790 | mso-ascii-theme-font:major-latin; |
|---|
| 791 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 792 | mso-fareast-theme-font:major-fareast; |
|---|
| 793 | mso-hansi-font-family:Cambria; |
|---|
| 794 | mso-hansi-theme-font:major-latin; |
|---|
| 795 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 796 | mso-bidi-theme-font:major-bidi; |
|---|
| 797 | color:#4F81BD; |
|---|
| 798 | mso-themecolor:accent1; |
|---|
| 799 | font-weight:bold;} |
|---|
| 800 | span.Heading3Char |
|---|
| 801 | {mso-style-name:"Heading 3 Char"; |
|---|
| 802 | mso-style-noshow:yes; |
|---|
| 803 | mso-style-priority:9; |
|---|
| 804 | mso-style-unhide:no; |
|---|
| 805 | mso-style-locked:yes; |
|---|
| 806 | mso-style-link:"Heading 3"; |
|---|
| 807 | mso-ansi-font-size:12.0pt; |
|---|
| 808 | mso-bidi-font-size:12.0pt; |
|---|
| 809 | font-family:"Cambria","serif"; |
|---|
| 810 | mso-ascii-font-family:Cambria; |
|---|
| 811 | mso-ascii-theme-font:major-latin; |
|---|
| 812 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 813 | mso-fareast-theme-font:major-fareast; |
|---|
| 814 | mso-hansi-font-family:Cambria; |
|---|
| 815 | mso-hansi-theme-font:major-latin; |
|---|
| 816 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 817 | mso-bidi-theme-font:major-bidi; |
|---|
| 818 | color:#4F81BD; |
|---|
| 819 | mso-themecolor:accent1; |
|---|
| 820 | font-weight:bold;} |
|---|
| 821 | span.Heading4Char |
|---|
| 822 | {mso-style-name:"Heading 4 Char"; |
|---|
| 823 | mso-style-noshow:yes; |
|---|
| 824 | mso-style-priority:9; |
|---|
| 825 | mso-style-unhide:no; |
|---|
| 826 | mso-style-locked:yes; |
|---|
| 827 | mso-style-link:"Heading 4"; |
|---|
| 828 | mso-ansi-font-size:12.0pt; |
|---|
| 829 | mso-bidi-font-size:12.0pt; |
|---|
| 830 | font-family:"Cambria","serif"; |
|---|
| 831 | mso-ascii-font-family:Cambria; |
|---|
| 832 | mso-ascii-theme-font:major-latin; |
|---|
| 833 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 834 | mso-fareast-theme-font:major-fareast; |
|---|
| 835 | mso-hansi-font-family:Cambria; |
|---|
| 836 | mso-hansi-theme-font:major-latin; |
|---|
| 837 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 838 | mso-bidi-theme-font:major-bidi; |
|---|
| 839 | color:#4F81BD; |
|---|
| 840 | mso-themecolor:accent1; |
|---|
| 841 | font-weight:bold; |
|---|
| 842 | font-style:italic;} |
|---|
| 843 | span.Heading5Char |
|---|
| 844 | {mso-style-name:"Heading 5 Char"; |
|---|
| 845 | mso-style-noshow:yes; |
|---|
| 846 | mso-style-priority:9; |
|---|
| 847 | mso-style-unhide:no; |
|---|
| 848 | mso-style-locked:yes; |
|---|
| 849 | mso-style-link:"Heading 5"; |
|---|
| 850 | mso-ansi-font-size:12.0pt; |
|---|
| 851 | mso-bidi-font-size:12.0pt; |
|---|
| 852 | font-family:"Cambria","serif"; |
|---|
| 853 | mso-ascii-font-family:Cambria; |
|---|
| 854 | mso-ascii-theme-font:major-latin; |
|---|
| 855 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 856 | mso-fareast-theme-font:major-fareast; |
|---|
| 857 | mso-hansi-font-family:Cambria; |
|---|
| 858 | mso-hansi-theme-font:major-latin; |
|---|
| 859 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 860 | mso-bidi-theme-font:major-bidi; |
|---|
| 861 | color:#243F60; |
|---|
| 862 | mso-themecolor:accent1; |
|---|
| 863 | mso-themeshade:127;} |
|---|
| 864 | span.HTMLPreformattedChar |
|---|
| 865 | {mso-style-name:"HTML Preformatted Char"; |
|---|
| 866 | mso-style-noshow:yes; |
|---|
| 867 | mso-style-priority:99; |
|---|
| 868 | mso-style-unhide:no; |
|---|
| 869 | mso-style-locked:yes; |
|---|
| 870 | mso-style-link:"HTML Preformatted"; |
|---|
| 871 | font-family:"Courier New"; |
|---|
| 872 | mso-ascii-font-family:"Courier New"; |
|---|
| 873 | mso-hansi-font-family:"Courier New"; |
|---|
| 874 | mso-bidi-font-family:"Courier New";} |
|---|
| 875 | span.TitleChar |
|---|
| 876 | {mso-style-name:"Title Char"; |
|---|
| 877 | mso-style-priority:10; |
|---|
| 878 | mso-style-unhide:no; |
|---|
| 879 | mso-style-locked:yes; |
|---|
| 880 | mso-style-link:Title; |
|---|
| 881 | mso-ansi-font-size:26.0pt; |
|---|
| 882 | mso-bidi-font-size:26.0pt; |
|---|
| 883 | font-family:"Cambria","serif"; |
|---|
| 884 | mso-ascii-font-family:Cambria; |
|---|
| 885 | mso-ascii-theme-font:major-latin; |
|---|
| 886 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 887 | mso-fareast-theme-font:major-fareast; |
|---|
| 888 | mso-hansi-font-family:Cambria; |
|---|
| 889 | mso-hansi-theme-font:major-latin; |
|---|
| 890 | mso-bidi-font-family:"Times New Roman"; |
|---|
| 891 | mso-bidi-theme-font:major-bidi; |
|---|
| 892 | color:#17365D; |
|---|
| 893 | mso-themecolor:text2; |
|---|
| 894 | mso-themeshade:191; |
|---|
| 895 | letter-spacing:.25pt; |
|---|
| 896 | mso-font-kerning:14.0pt;} |
|---|
| 897 | span.DocumentMapChar |
|---|
| 898 | {mso-style-name:"Document Map Char"; |
|---|
| 899 | mso-style-noshow:yes; |
|---|
| 900 | mso-style-priority:99; |
|---|
| 901 | mso-style-unhide:no; |
|---|
| 902 | mso-style-locked:yes; |
|---|
| 903 | mso-style-link:"Document Map"; |
|---|
| 904 | mso-ansi-font-size:8.0pt; |
|---|
| 905 | mso-bidi-font-size:8.0pt; |
|---|
| 906 | font-family:"Tahoma","sans-serif"; |
|---|
| 907 | mso-ascii-font-family:Tahoma; |
|---|
| 908 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 909 | mso-fareast-theme-font:minor-fareast; |
|---|
| 910 | mso-hansi-font-family:Tahoma; |
|---|
| 911 | mso-bidi-font-family:Tahoma;} |
|---|
| 912 | span.BalloonTextChar |
|---|
| 913 | {mso-style-name:"Balloon Text Char"; |
|---|
| 914 | mso-style-noshow:yes; |
|---|
| 915 | mso-style-priority:99; |
|---|
| 916 | mso-style-unhide:no; |
|---|
| 917 | mso-style-locked:yes; |
|---|
| 918 | mso-style-link:"Balloon Text"; |
|---|
| 919 | mso-ansi-font-size:8.0pt; |
|---|
| 920 | mso-bidi-font-size:8.0pt; |
|---|
| 921 | font-family:"Tahoma","sans-serif"; |
|---|
| 922 | mso-ascii-font-family:Tahoma; |
|---|
| 923 | mso-fareast-font-family:"Times New Roman"; |
|---|
| 924 | mso-fareast-theme-font:minor-fareast; |
|---|
| 925 | mso-hansi-font-family:Tahoma; |
|---|
| 926 | mso-bidi-font-family:Tahoma;} |
|---|
| 927 | span.SpellE |
|---|
| 928 | {mso-style-name:""; |
|---|
| 929 | mso-spl-e:yes;} |
|---|
| 930 | span.GramE |
|---|
| 931 | {mso-style-name:""; |
|---|
| 932 | mso-gram-e:yes;} |
|---|
| 933 | .MsoChpDefault |
|---|
| 934 | {mso-style-type:export-only; |
|---|
| 935 | mso-default-props:yes; |
|---|
| 936 | font-size:10.0pt; |
|---|
| 937 | mso-ansi-font-size:10.0pt; |
|---|
| 938 | mso-bidi-font-size:10.0pt;} |
|---|
| 939 | @page WordSection1 |
|---|
| 940 | {size:8.5in 11.0in; |
|---|
| 941 | margin:1.0in 1.0in 1.0in 1.0in; |
|---|
| 942 | mso-header-margin:.5in; |
|---|
| 943 | mso-footer-margin:.5in; |
|---|
| 944 | mso-paper-source:0;} |
|---|
| 945 | div.WordSection1 |
|---|
| 946 | {page:WordSection1;} |
|---|
| 947 | /* List Definitions */ |
|---|
| 948 | @list l0 |
|---|
| 949 | {mso-list-id:142163818; |
|---|
| 950 | mso-list-type:hybrid; |
|---|
| 951 | mso-list-template-ids:773461610 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 952 | @list l0:level1 |
|---|
| 953 | {mso-level-tab-stop:none; |
|---|
| 954 | mso-level-number-position:left; |
|---|
| 955 | text-indent:-.25in;} |
|---|
| 956 | @list l0:level2 |
|---|
| 957 | {mso-level-number-format:alpha-lower; |
|---|
| 958 | mso-level-tab-stop:none; |
|---|
| 959 | mso-level-number-position:left; |
|---|
| 960 | text-indent:-.25in;} |
|---|
| 961 | @list l0:level3 |
|---|
| 962 | {mso-level-number-format:roman-lower; |
|---|
| 963 | mso-level-tab-stop:none; |
|---|
| 964 | mso-level-number-position:right; |
|---|
| 965 | text-indent:-9.0pt;} |
|---|
| 966 | @list l0:level4 |
|---|
| 967 | {mso-level-tab-stop:2.0in; |
|---|
| 968 | mso-level-number-position:left; |
|---|
| 969 | text-indent:-.25in;} |
|---|
| 970 | @list l0:level5 |
|---|
| 971 | {mso-level-tab-stop:2.5in; |
|---|
| 972 | mso-level-number-position:left; |
|---|
| 973 | text-indent:-.25in;} |
|---|
| 974 | @list l0:level6 |
|---|
| 975 | {mso-level-tab-stop:3.0in; |
|---|
| 976 | mso-level-number-position:left; |
|---|
| 977 | text-indent:-.25in;} |
|---|
| 978 | @list l0:level7 |
|---|
| 979 | {mso-level-tab-stop:3.5in; |
|---|
| 980 | mso-level-number-position:left; |
|---|
| 981 | text-indent:-.25in;} |
|---|
| 982 | @list l0:level8 |
|---|
| 983 | {mso-level-tab-stop:4.0in; |
|---|
| 984 | mso-level-number-position:left; |
|---|
| 985 | text-indent:-.25in;} |
|---|
| 986 | @list l0:level9 |
|---|
| 987 | {mso-level-tab-stop:4.5in; |
|---|
| 988 | mso-level-number-position:left; |
|---|
| 989 | text-indent:-.25in;} |
|---|
| 990 | @list l1 |
|---|
| 991 | {mso-list-id:203979460; |
|---|
| 992 | mso-list-template-ids:88359672;} |
|---|
| 993 | @list l1:level1 |
|---|
| 994 | {mso-level-number-format:bullet; |
|---|
| 995 | mso-level-text:\F0B7; |
|---|
| 996 | mso-level-tab-stop:.5in; |
|---|
| 997 | mso-level-number-position:left; |
|---|
| 998 | text-indent:-.25in; |
|---|
| 999 | mso-ansi-font-size:10.0pt; |
|---|
| 1000 | font-family:Symbol;} |
|---|
| 1001 | @list l1:level2 |
|---|
| 1002 | {mso-level-tab-stop:1.0in; |
|---|
| 1003 | mso-level-number-position:left; |
|---|
| 1004 | text-indent:-.25in;} |
|---|
| 1005 | @list l1:level3 |
|---|
| 1006 | {mso-level-tab-stop:1.5in; |
|---|
| 1007 | mso-level-number-position:left; |
|---|
| 1008 | text-indent:-.25in;} |
|---|
| 1009 | @list l1:level4 |
|---|
| 1010 | {mso-level-tab-stop:2.0in; |
|---|
| 1011 | mso-level-number-position:left; |
|---|
| 1012 | text-indent:-.25in;} |
|---|
| 1013 | @list l1:level5 |
|---|
| 1014 | {mso-level-tab-stop:2.5in; |
|---|
| 1015 | mso-level-number-position:left; |
|---|
| 1016 | text-indent:-.25in;} |
|---|
| 1017 | @list l1:level6 |
|---|
| 1018 | {mso-level-tab-stop:3.0in; |
|---|
| 1019 | mso-level-number-position:left; |
|---|
| 1020 | text-indent:-.25in;} |
|---|
| 1021 | @list l1:level7 |
|---|
| 1022 | {mso-level-tab-stop:3.5in; |
|---|
| 1023 | mso-level-number-position:left; |
|---|
| 1024 | text-indent:-.25in;} |
|---|
| 1025 | @list l1:level8 |
|---|
| 1026 | {mso-level-tab-stop:4.0in; |
|---|
| 1027 | mso-level-number-position:left; |
|---|
| 1028 | text-indent:-.25in;} |
|---|
| 1029 | @list l1:level9 |
|---|
| 1030 | {mso-level-tab-stop:4.5in; |
|---|
| 1031 | mso-level-number-position:left; |
|---|
| 1032 | text-indent:-.25in;} |
|---|
| 1033 | @list l2 |
|---|
| 1034 | {mso-list-id:268514595; |
|---|
| 1035 | mso-list-type:hybrid; |
|---|
| 1036 | mso-list-template-ids:-1814001090 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1037 | @list l2:level1 |
|---|
| 1038 | {mso-level-number-format:alpha-lower; |
|---|
| 1039 | mso-level-tab-stop:none; |
|---|
| 1040 | mso-level-number-position:left; |
|---|
| 1041 | margin-left:1.0in; |
|---|
| 1042 | text-indent:-.25in; |
|---|
| 1043 | mso-ansi-font-weight:normal;} |
|---|
| 1044 | @list l2:level2 |
|---|
| 1045 | {mso-level-tab-stop:1.0in; |
|---|
| 1046 | mso-level-number-position:left; |
|---|
| 1047 | text-indent:-.25in;} |
|---|
| 1048 | @list l2:level3 |
|---|
| 1049 | {mso-level-tab-stop:112.5pt; |
|---|
| 1050 | mso-level-number-position:left; |
|---|
| 1051 | margin-left:112.5pt; |
|---|
| 1052 | text-indent:-.25in;} |
|---|
| 1053 | @list l2:level4 |
|---|
| 1054 | {mso-level-tab-stop:2.0in; |
|---|
| 1055 | mso-level-number-position:left; |
|---|
| 1056 | text-indent:-.25in;} |
|---|
| 1057 | @list l2:level5 |
|---|
| 1058 | {mso-level-tab-stop:2.5in; |
|---|
| 1059 | mso-level-number-position:left; |
|---|
| 1060 | text-indent:-.25in;} |
|---|
| 1061 | @list l2:level6 |
|---|
| 1062 | {mso-level-tab-stop:3.0in; |
|---|
| 1063 | mso-level-number-position:left; |
|---|
| 1064 | text-indent:-.25in;} |
|---|
| 1065 | @list l2:level7 |
|---|
| 1066 | {mso-level-tab-stop:3.5in; |
|---|
| 1067 | mso-level-number-position:left; |
|---|
| 1068 | text-indent:-.25in;} |
|---|
| 1069 | @list l2:level8 |
|---|
| 1070 | {mso-level-tab-stop:4.0in; |
|---|
| 1071 | mso-level-number-position:left; |
|---|
| 1072 | text-indent:-.25in;} |
|---|
| 1073 | @list l2:level9 |
|---|
| 1074 | {mso-level-tab-stop:4.5in; |
|---|
| 1075 | mso-level-number-position:left; |
|---|
| 1076 | text-indent:-.25in;} |
|---|
| 1077 | @list l3 |
|---|
| 1078 | {mso-list-id:301277244; |
|---|
| 1079 | mso-list-template-ids:-445226636;} |
|---|
| 1080 | @list l3:level1 |
|---|
| 1081 | {mso-level-tab-stop:none; |
|---|
| 1082 | mso-level-number-position:left; |
|---|
| 1083 | text-indent:-.25in;} |
|---|
| 1084 | @list l3:level2 |
|---|
| 1085 | {mso-level-number-format:alpha-lower; |
|---|
| 1086 | mso-level-tab-stop:1.0in; |
|---|
| 1087 | mso-level-number-position:left; |
|---|
| 1088 | text-indent:-.25in;} |
|---|
| 1089 | @list l3:level3 |
|---|
| 1090 | {mso-level-tab-stop:1.5in; |
|---|
| 1091 | mso-level-number-position:left; |
|---|
| 1092 | text-indent:-.25in;} |
|---|
| 1093 | @list l3:level4 |
|---|
| 1094 | {mso-level-number-format:alpha-lower; |
|---|
| 1095 | mso-level-tab-stop:2.0in; |
|---|
| 1096 | mso-level-number-position:left; |
|---|
| 1097 | text-indent:-.25in;} |
|---|
| 1098 | @list l3:level5 |
|---|
| 1099 | {mso-level-tab-stop:2.5in; |
|---|
| 1100 | mso-level-number-position:left; |
|---|
| 1101 | text-indent:-.25in;} |
|---|
| 1102 | @list l3:level6 |
|---|
| 1103 | {mso-level-tab-stop:3.0in; |
|---|
| 1104 | mso-level-number-position:left; |
|---|
| 1105 | text-indent:-.25in;} |
|---|
| 1106 | @list l3:level7 |
|---|
| 1107 | {mso-level-tab-stop:3.5in; |
|---|
| 1108 | mso-level-number-position:left; |
|---|
| 1109 | text-indent:-.25in;} |
|---|
| 1110 | @list l3:level8 |
|---|
| 1111 | {mso-level-tab-stop:4.0in; |
|---|
| 1112 | mso-level-number-position:left; |
|---|
| 1113 | text-indent:-.25in;} |
|---|
| 1114 | @list l3:level9 |
|---|
| 1115 | {mso-level-tab-stop:4.5in; |
|---|
| 1116 | mso-level-number-position:left; |
|---|
| 1117 | text-indent:-.25in;} |
|---|
| 1118 | @list l4 |
|---|
| 1119 | {mso-list-id:424421782; |
|---|
| 1120 | mso-list-template-ids:-445226636;} |
|---|
| 1121 | @list l4:level1 |
|---|
| 1122 | {mso-level-tab-stop:none; |
|---|
| 1123 | mso-level-number-position:left; |
|---|
| 1124 | text-indent:-.25in;} |
|---|
| 1125 | @list l4:level2 |
|---|
| 1126 | {mso-level-number-format:alpha-lower; |
|---|
| 1127 | mso-level-tab-stop:1.0in; |
|---|
| 1128 | mso-level-number-position:left; |
|---|
| 1129 | text-indent:-.25in;} |
|---|
| 1130 | @list l4:level3 |
|---|
| 1131 | {mso-level-tab-stop:1.5in; |
|---|
| 1132 | mso-level-number-position:left; |
|---|
| 1133 | text-indent:-.25in;} |
|---|
| 1134 | @list l4:level4 |
|---|
| 1135 | {mso-level-number-format:alpha-lower; |
|---|
| 1136 | mso-level-tab-stop:2.0in; |
|---|
| 1137 | mso-level-number-position:left; |
|---|
| 1138 | text-indent:-.25in;} |
|---|
| 1139 | @list l4:level5 |
|---|
| 1140 | {mso-level-tab-stop:2.5in; |
|---|
| 1141 | mso-level-number-position:left; |
|---|
| 1142 | text-indent:-.25in;} |
|---|
| 1143 | @list l4:level6 |
|---|
| 1144 | {mso-level-tab-stop:3.0in; |
|---|
| 1145 | mso-level-number-position:left; |
|---|
| 1146 | text-indent:-.25in;} |
|---|
| 1147 | @list l4:level7 |
|---|
| 1148 | {mso-level-tab-stop:3.5in; |
|---|
| 1149 | mso-level-number-position:left; |
|---|
| 1150 | text-indent:-.25in;} |
|---|
| 1151 | @list l4:level8 |
|---|
| 1152 | {mso-level-tab-stop:4.0in; |
|---|
| 1153 | mso-level-number-position:left; |
|---|
| 1154 | text-indent:-.25in;} |
|---|
| 1155 | @list l4:level9 |
|---|
| 1156 | {mso-level-tab-stop:4.5in; |
|---|
| 1157 | mso-level-number-position:left; |
|---|
| 1158 | text-indent:-.25in;} |
|---|
| 1159 | @list l5 |
|---|
| 1160 | {mso-list-id:617220658; |
|---|
| 1161 | mso-list-type:hybrid; |
|---|
| 1162 | mso-list-template-ids:1177170962 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1163 | @list l5:level1 |
|---|
| 1164 | {mso-level-tab-stop:none; |
|---|
| 1165 | mso-level-number-position:left; |
|---|
| 1166 | text-indent:-.25in;} |
|---|
| 1167 | @list l5:level2 |
|---|
| 1168 | {mso-level-tab-stop:1.0in; |
|---|
| 1169 | mso-level-number-position:left; |
|---|
| 1170 | text-indent:-.25in;} |
|---|
| 1171 | @list l5:level3 |
|---|
| 1172 | {mso-level-tab-stop:1.5in; |
|---|
| 1173 | mso-level-number-position:left; |
|---|
| 1174 | text-indent:-.25in;} |
|---|
| 1175 | @list l5:level4 |
|---|
| 1176 | {mso-level-tab-stop:2.0in; |
|---|
| 1177 | mso-level-number-position:left; |
|---|
| 1178 | text-indent:-.25in;} |
|---|
| 1179 | @list l5:level5 |
|---|
| 1180 | {mso-level-tab-stop:2.5in; |
|---|
| 1181 | mso-level-number-position:left; |
|---|
| 1182 | text-indent:-.25in;} |
|---|
| 1183 | @list l5:level6 |
|---|
| 1184 | {mso-level-tab-stop:3.0in; |
|---|
| 1185 | mso-level-number-position:left; |
|---|
| 1186 | text-indent:-.25in;} |
|---|
| 1187 | @list l5:level7 |
|---|
| 1188 | {mso-level-tab-stop:3.5in; |
|---|
| 1189 | mso-level-number-position:left; |
|---|
| 1190 | text-indent:-.25in;} |
|---|
| 1191 | @list l5:level8 |
|---|
| 1192 | {mso-level-tab-stop:4.0in; |
|---|
| 1193 | mso-level-number-position:left; |
|---|
| 1194 | text-indent:-.25in;} |
|---|
| 1195 | @list l5:level9 |
|---|
| 1196 | {mso-level-tab-stop:4.5in; |
|---|
| 1197 | mso-level-number-position:left; |
|---|
| 1198 | text-indent:-.25in;} |
|---|
| 1199 | @list l6 |
|---|
| 1200 | {mso-list-id:649361966; |
|---|
| 1201 | mso-list-template-ids:326264828;} |
|---|
| 1202 | @list l6:level1 |
|---|
| 1203 | {mso-level-tab-stop:none; |
|---|
| 1204 | mso-level-number-position:left; |
|---|
| 1205 | text-indent:-.25in;} |
|---|
| 1206 | @list l6:level2 |
|---|
| 1207 | {mso-level-number-format:alpha-lower; |
|---|
| 1208 | mso-level-tab-stop:1.0in; |
|---|
| 1209 | mso-level-number-position:left; |
|---|
| 1210 | text-indent:-.25in; |
|---|
| 1211 | mso-ansi-font-size:12.0pt; |
|---|
| 1212 | font-family:"Times New Roman","serif"; |
|---|
| 1213 | mso-ansi-font-weight:normal; |
|---|
| 1214 | mso-ansi-font-style:normal;} |
|---|
| 1215 | @list l6:level3 |
|---|
| 1216 | {mso-level-tab-stop:1.5in; |
|---|
| 1217 | mso-level-number-position:left; |
|---|
| 1218 | text-indent:-.25in;} |
|---|
| 1219 | @list l6:level4 |
|---|
| 1220 | {mso-level-number-format:alpha-lower; |
|---|
| 1221 | mso-level-tab-stop:2.0in; |
|---|
| 1222 | mso-level-number-position:left; |
|---|
| 1223 | text-indent:-.25in;} |
|---|
| 1224 | @list l6:level5 |
|---|
| 1225 | {mso-level-tab-stop:2.5in; |
|---|
| 1226 | mso-level-number-position:left; |
|---|
| 1227 | text-indent:-.25in;} |
|---|
| 1228 | @list l6:level6 |
|---|
| 1229 | {mso-level-tab-stop:3.0in; |
|---|
| 1230 | mso-level-number-position:left; |
|---|
| 1231 | text-indent:-.25in;} |
|---|
| 1232 | @list l6:level7 |
|---|
| 1233 | {mso-level-tab-stop:3.5in; |
|---|
| 1234 | mso-level-number-position:left; |
|---|
| 1235 | text-indent:-.25in;} |
|---|
| 1236 | @list l6:level8 |
|---|
| 1237 | {mso-level-tab-stop:4.0in; |
|---|
| 1238 | mso-level-number-position:left; |
|---|
| 1239 | text-indent:-.25in;} |
|---|
| 1240 | @list l6:level9 |
|---|
| 1241 | {mso-level-tab-stop:4.5in; |
|---|
| 1242 | mso-level-number-position:left; |
|---|
| 1243 | text-indent:-.25in;} |
|---|
| 1244 | @list l7 |
|---|
| 1245 | {mso-list-id:656106218; |
|---|
| 1246 | mso-list-type:hybrid; |
|---|
| 1247 | mso-list-template-ids:185874704 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1248 | @list l7:level1 |
|---|
| 1249 | {mso-level-tab-stop:none; |
|---|
| 1250 | mso-level-number-position:left; |
|---|
| 1251 | text-indent:-.25in;} |
|---|
| 1252 | @list l7:level2 |
|---|
| 1253 | {mso-level-tab-stop:1.0in; |
|---|
| 1254 | mso-level-number-position:left; |
|---|
| 1255 | text-indent:-.25in;} |
|---|
| 1256 | @list l7:level3 |
|---|
| 1257 | {mso-level-tab-stop:1.5in; |
|---|
| 1258 | mso-level-number-position:left; |
|---|
| 1259 | text-indent:-.25in;} |
|---|
| 1260 | @list l7:level4 |
|---|
| 1261 | {mso-level-tab-stop:2.0in; |
|---|
| 1262 | mso-level-number-position:left; |
|---|
| 1263 | text-indent:-.25in;} |
|---|
| 1264 | @list l7:level5 |
|---|
| 1265 | {mso-level-tab-stop:2.5in; |
|---|
| 1266 | mso-level-number-position:left; |
|---|
| 1267 | text-indent:-.25in;} |
|---|
| 1268 | @list l7:level6 |
|---|
| 1269 | {mso-level-tab-stop:3.0in; |
|---|
| 1270 | mso-level-number-position:left; |
|---|
| 1271 | text-indent:-.25in;} |
|---|
| 1272 | @list l7:level7 |
|---|
| 1273 | {mso-level-tab-stop:3.5in; |
|---|
| 1274 | mso-level-number-position:left; |
|---|
| 1275 | text-indent:-.25in;} |
|---|
| 1276 | @list l7:level8 |
|---|
| 1277 | {mso-level-tab-stop:4.0in; |
|---|
| 1278 | mso-level-number-position:left; |
|---|
| 1279 | text-indent:-.25in;} |
|---|
| 1280 | @list l7:level9 |
|---|
| 1281 | {mso-level-tab-stop:4.5in; |
|---|
| 1282 | mso-level-number-position:left; |
|---|
| 1283 | text-indent:-.25in;} |
|---|
| 1284 | @list l8 |
|---|
| 1285 | {mso-list-id:734669460; |
|---|
| 1286 | mso-list-type:hybrid; |
|---|
| 1287 | mso-list-template-ids:1988758972 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1288 | @list l8:level1 |
|---|
| 1289 | {mso-level-tab-stop:none; |
|---|
| 1290 | mso-level-number-position:left; |
|---|
| 1291 | text-indent:-.25in;} |
|---|
| 1292 | @list l8:level2 |
|---|
| 1293 | {mso-level-tab-stop:1.0in; |
|---|
| 1294 | mso-level-number-position:left; |
|---|
| 1295 | text-indent:-.25in;} |
|---|
| 1296 | @list l8:level3 |
|---|
| 1297 | {mso-level-tab-stop:1.5in; |
|---|
| 1298 | mso-level-number-position:left; |
|---|
| 1299 | text-indent:-.25in;} |
|---|
| 1300 | @list l8:level4 |
|---|
| 1301 | {mso-level-tab-stop:2.0in; |
|---|
| 1302 | mso-level-number-position:left; |
|---|
| 1303 | text-indent:-.25in;} |
|---|
| 1304 | @list l8:level5 |
|---|
| 1305 | {mso-level-tab-stop:2.5in; |
|---|
| 1306 | mso-level-number-position:left; |
|---|
| 1307 | text-indent:-.25in;} |
|---|
| 1308 | @list l8:level6 |
|---|
| 1309 | {mso-level-tab-stop:3.0in; |
|---|
| 1310 | mso-level-number-position:left; |
|---|
| 1311 | text-indent:-.25in;} |
|---|
| 1312 | @list l8:level7 |
|---|
| 1313 | {mso-level-tab-stop:3.5in; |
|---|
| 1314 | mso-level-number-position:left; |
|---|
| 1315 | text-indent:-.25in;} |
|---|
| 1316 | @list l8:level8 |
|---|
| 1317 | {mso-level-tab-stop:4.0in; |
|---|
| 1318 | mso-level-number-position:left; |
|---|
| 1319 | text-indent:-.25in;} |
|---|
| 1320 | @list l8:level9 |
|---|
| 1321 | {mso-level-tab-stop:4.5in; |
|---|
| 1322 | mso-level-number-position:left; |
|---|
| 1323 | text-indent:-.25in;} |
|---|
| 1324 | @list l9 |
|---|
| 1325 | {mso-list-id:742676264; |
|---|
| 1326 | mso-list-template-ids:326264828;} |
|---|
| 1327 | @list l9:level1 |
|---|
| 1328 | {mso-level-tab-stop:none; |
|---|
| 1329 | mso-level-number-position:left; |
|---|
| 1330 | text-indent:-.25in;} |
|---|
| 1331 | @list l9:level2 |
|---|
| 1332 | {mso-level-number-format:alpha-lower; |
|---|
| 1333 | mso-level-tab-stop:1.0in; |
|---|
| 1334 | mso-level-number-position:left; |
|---|
| 1335 | text-indent:-.25in; |
|---|
| 1336 | mso-ansi-font-size:12.0pt; |
|---|
| 1337 | font-family:"Times New Roman","serif"; |
|---|
| 1338 | mso-ansi-font-weight:normal; |
|---|
| 1339 | mso-ansi-font-style:normal;} |
|---|
| 1340 | @list l9:level3 |
|---|
| 1341 | {mso-level-tab-stop:1.5in; |
|---|
| 1342 | mso-level-number-position:left; |
|---|
| 1343 | text-indent:-.25in;} |
|---|
| 1344 | @list l9:level4 |
|---|
| 1345 | {mso-level-number-format:alpha-lower; |
|---|
| 1346 | mso-level-tab-stop:2.0in; |
|---|
| 1347 | mso-level-number-position:left; |
|---|
| 1348 | text-indent:-.25in;} |
|---|
| 1349 | @list l9:level5 |
|---|
| 1350 | {mso-level-tab-stop:2.5in; |
|---|
| 1351 | mso-level-number-position:left; |
|---|
| 1352 | text-indent:-.25in;} |
|---|
| 1353 | @list l9:level6 |
|---|
| 1354 | {mso-level-tab-stop:3.0in; |
|---|
| 1355 | mso-level-number-position:left; |
|---|
| 1356 | text-indent:-.25in;} |
|---|
| 1357 | @list l9:level7 |
|---|
| 1358 | {mso-level-tab-stop:3.5in; |
|---|
| 1359 | mso-level-number-position:left; |
|---|
| 1360 | text-indent:-.25in;} |
|---|
| 1361 | @list l9:level8 |
|---|
| 1362 | {mso-level-tab-stop:4.0in; |
|---|
| 1363 | mso-level-number-position:left; |
|---|
| 1364 | text-indent:-.25in;} |
|---|
| 1365 | @list l9:level9 |
|---|
| 1366 | {mso-level-tab-stop:4.5in; |
|---|
| 1367 | mso-level-number-position:left; |
|---|
| 1368 | text-indent:-.25in;} |
|---|
| 1369 | @list l10 |
|---|
| 1370 | {mso-list-id:919948450; |
|---|
| 1371 | mso-list-type:hybrid; |
|---|
| 1372 | mso-list-template-ids:-1980985146 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1373 | @list l10:level1 |
|---|
| 1374 | {mso-level-tab-stop:none; |
|---|
| 1375 | mso-level-number-position:left; |
|---|
| 1376 | text-indent:-.25in;} |
|---|
| 1377 | @list l10:level2 |
|---|
| 1378 | {mso-level-tab-stop:1.0in; |
|---|
| 1379 | mso-level-number-position:left; |
|---|
| 1380 | text-indent:-.25in;} |
|---|
| 1381 | @list l10:level3 |
|---|
| 1382 | {mso-level-tab-stop:1.5in; |
|---|
| 1383 | mso-level-number-position:left; |
|---|
| 1384 | text-indent:-.25in;} |
|---|
| 1385 | @list l10:level4 |
|---|
| 1386 | {mso-level-tab-stop:2.0in; |
|---|
| 1387 | mso-level-number-position:left; |
|---|
| 1388 | text-indent:-.25in;} |
|---|
| 1389 | @list l10:level5 |
|---|
| 1390 | {mso-level-tab-stop:2.5in; |
|---|
| 1391 | mso-level-number-position:left; |
|---|
| 1392 | text-indent:-.25in;} |
|---|
| 1393 | @list l10:level6 |
|---|
| 1394 | {mso-level-tab-stop:3.0in; |
|---|
| 1395 | mso-level-number-position:left; |
|---|
| 1396 | text-indent:-.25in;} |
|---|
| 1397 | @list l10:level7 |
|---|
| 1398 | {mso-level-tab-stop:3.5in; |
|---|
| 1399 | mso-level-number-position:left; |
|---|
| 1400 | text-indent:-.25in;} |
|---|
| 1401 | @list l10:level8 |
|---|
| 1402 | {mso-level-tab-stop:4.0in; |
|---|
| 1403 | mso-level-number-position:left; |
|---|
| 1404 | text-indent:-.25in;} |
|---|
| 1405 | @list l10:level9 |
|---|
| 1406 | {mso-level-tab-stop:4.5in; |
|---|
| 1407 | mso-level-number-position:left; |
|---|
| 1408 | text-indent:-.25in;} |
|---|
| 1409 | @list l11 |
|---|
| 1410 | {mso-list-id:1035230400; |
|---|
| 1411 | mso-list-type:hybrid; |
|---|
| 1412 | mso-list-template-ids:-2012591744 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1413 | @list l11:level1 |
|---|
| 1414 | {mso-level-tab-stop:none; |
|---|
| 1415 | mso-level-number-position:left; |
|---|
| 1416 | text-indent:-.25in;} |
|---|
| 1417 | @list l11:level2 |
|---|
| 1418 | {mso-level-number-format:alpha-lower; |
|---|
| 1419 | mso-level-tab-stop:none; |
|---|
| 1420 | mso-level-number-position:left; |
|---|
| 1421 | text-indent:-.25in;} |
|---|
| 1422 | @list l11:level3 |
|---|
| 1423 | {mso-level-tab-stop:1.5in; |
|---|
| 1424 | mso-level-number-position:left; |
|---|
| 1425 | text-indent:-.25in;} |
|---|
| 1426 | @list l11:level4 |
|---|
| 1427 | {mso-level-tab-stop:2.0in; |
|---|
| 1428 | mso-level-number-position:left; |
|---|
| 1429 | text-indent:-.25in;} |
|---|
| 1430 | @list l11:level5 |
|---|
| 1431 | {mso-level-tab-stop:2.5in; |
|---|
| 1432 | mso-level-number-position:left; |
|---|
| 1433 | text-indent:-.25in;} |
|---|
| 1434 | @list l11:level6 |
|---|
| 1435 | {mso-level-tab-stop:3.0in; |
|---|
| 1436 | mso-level-number-position:left; |
|---|
| 1437 | text-indent:-.25in;} |
|---|
| 1438 | @list l11:level7 |
|---|
| 1439 | {mso-level-tab-stop:3.5in; |
|---|
| 1440 | mso-level-number-position:left; |
|---|
| 1441 | text-indent:-.25in;} |
|---|
| 1442 | @list l11:level8 |
|---|
| 1443 | {mso-level-tab-stop:4.0in; |
|---|
| 1444 | mso-level-number-position:left; |
|---|
| 1445 | text-indent:-.25in;} |
|---|
| 1446 | @list l11:level9 |
|---|
| 1447 | {mso-level-tab-stop:4.5in; |
|---|
| 1448 | mso-level-number-position:left; |
|---|
| 1449 | text-indent:-.25in;} |
|---|
| 1450 | @list l12 |
|---|
| 1451 | {mso-list-id:1074664733; |
|---|
| 1452 | mso-list-type:hybrid; |
|---|
| 1453 | mso-list-template-ids:2033622918 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1454 | @list l12:level1 |
|---|
| 1455 | {mso-level-number-format:alpha-lower; |
|---|
| 1456 | mso-level-tab-stop:none; |
|---|
| 1457 | mso-level-number-position:left; |
|---|
| 1458 | margin-left:1.0in; |
|---|
| 1459 | text-indent:-.25in; |
|---|
| 1460 | mso-ansi-font-weight:normal;} |
|---|
| 1461 | @list l12:level2 |
|---|
| 1462 | {mso-level-number-format:alpha-lower; |
|---|
| 1463 | mso-level-tab-stop:none; |
|---|
| 1464 | mso-level-number-position:left; |
|---|
| 1465 | text-indent:-.25in;} |
|---|
| 1466 | @list l12:level3 |
|---|
| 1467 | {mso-level-tab-stop:1.5in; |
|---|
| 1468 | mso-level-number-position:left; |
|---|
| 1469 | text-indent:-.25in;} |
|---|
| 1470 | @list l12:level4 |
|---|
| 1471 | {mso-level-tab-stop:2.0in; |
|---|
| 1472 | mso-level-number-position:left; |
|---|
| 1473 | text-indent:-.25in;} |
|---|
| 1474 | @list l12:level5 |
|---|
| 1475 | {mso-level-tab-stop:2.5in; |
|---|
| 1476 | mso-level-number-position:left; |
|---|
| 1477 | text-indent:-.25in;} |
|---|
| 1478 | @list l12:level6 |
|---|
| 1479 | {mso-level-tab-stop:3.0in; |
|---|
| 1480 | mso-level-number-position:left; |
|---|
| 1481 | text-indent:-.25in;} |
|---|
| 1482 | @list l12:level7 |
|---|
| 1483 | {mso-level-tab-stop:3.5in; |
|---|
| 1484 | mso-level-number-position:left; |
|---|
| 1485 | text-indent:-.25in;} |
|---|
| 1486 | @list l12:level8 |
|---|
| 1487 | {mso-level-tab-stop:4.0in; |
|---|
| 1488 | mso-level-number-position:left; |
|---|
| 1489 | text-indent:-.25in;} |
|---|
| 1490 | @list l12:level9 |
|---|
| 1491 | {mso-level-tab-stop:4.5in; |
|---|
| 1492 | mso-level-number-position:left; |
|---|
| 1493 | text-indent:-.25in;} |
|---|
| 1494 | @list l13 |
|---|
| 1495 | {mso-list-id:1162892763; |
|---|
| 1496 | mso-list-type:hybrid; |
|---|
| 1497 | mso-list-template-ids:2091276960 -1984140816 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1498 | @list l13:level1 |
|---|
| 1499 | {mso-level-number-format:alpha-lower; |
|---|
| 1500 | mso-level-tab-stop:none; |
|---|
| 1501 | mso-level-number-position:left; |
|---|
| 1502 | margin-left:1.0in; |
|---|
| 1503 | text-indent:-.25in;} |
|---|
| 1504 | @list l13:level2 |
|---|
| 1505 | {mso-level-tab-stop:1.0in; |
|---|
| 1506 | mso-level-number-position:left; |
|---|
| 1507 | text-indent:-.25in;} |
|---|
| 1508 | @list l13:level3 |
|---|
| 1509 | {mso-level-tab-stop:1.5in; |
|---|
| 1510 | mso-level-number-position:left; |
|---|
| 1511 | text-indent:-.25in;} |
|---|
| 1512 | @list l13:level4 |
|---|
| 1513 | {mso-level-tab-stop:2.0in; |
|---|
| 1514 | mso-level-number-position:left; |
|---|
| 1515 | text-indent:-.25in;} |
|---|
| 1516 | @list l13:level5 |
|---|
| 1517 | {mso-level-tab-stop:2.5in; |
|---|
| 1518 | mso-level-number-position:left; |
|---|
| 1519 | text-indent:-.25in;} |
|---|
| 1520 | @list l13:level6 |
|---|
| 1521 | {mso-level-tab-stop:3.0in; |
|---|
| 1522 | mso-level-number-position:left; |
|---|
| 1523 | text-indent:-.25in;} |
|---|
| 1524 | @list l13:level7 |
|---|
| 1525 | {mso-level-tab-stop:3.5in; |
|---|
| 1526 | mso-level-number-position:left; |
|---|
| 1527 | text-indent:-.25in;} |
|---|
| 1528 | @list l13:level8 |
|---|
| 1529 | {mso-level-tab-stop:4.0in; |
|---|
| 1530 | mso-level-number-position:left; |
|---|
| 1531 | text-indent:-.25in;} |
|---|
| 1532 | @list l13:level9 |
|---|
| 1533 | {mso-level-tab-stop:4.5in; |
|---|
| 1534 | mso-level-number-position:left; |
|---|
| 1535 | text-indent:-.25in;} |
|---|
| 1536 | @list l14 |
|---|
| 1537 | {mso-list-id:1323200535; |
|---|
| 1538 | mso-list-type:hybrid; |
|---|
| 1539 | mso-list-template-ids:-720724778 859726762 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1540 | @list l14:level1 |
|---|
| 1541 | {mso-level-number-format:alpha-lower; |
|---|
| 1542 | mso-level-tab-stop:none; |
|---|
| 1543 | mso-level-number-position:left; |
|---|
| 1544 | margin-left:1.0in; |
|---|
| 1545 | text-indent:-.25in;} |
|---|
| 1546 | @list l14:level2 |
|---|
| 1547 | {mso-level-tab-stop:1.0in; |
|---|
| 1548 | mso-level-number-position:left; |
|---|
| 1549 | text-indent:-.25in;} |
|---|
| 1550 | @list l14:level3 |
|---|
| 1551 | {mso-level-tab-stop:1.5in; |
|---|
| 1552 | mso-level-number-position:left; |
|---|
| 1553 | text-indent:-.25in;} |
|---|
| 1554 | @list l14:level4 |
|---|
| 1555 | {mso-level-tab-stop:2.0in; |
|---|
| 1556 | mso-level-number-position:left; |
|---|
| 1557 | text-indent:-.25in;} |
|---|
| 1558 | @list l14:level5 |
|---|
| 1559 | {mso-level-tab-stop:2.5in; |
|---|
| 1560 | mso-level-number-position:left; |
|---|
| 1561 | text-indent:-.25in;} |
|---|
| 1562 | @list l14:level6 |
|---|
| 1563 | {mso-level-tab-stop:3.0in; |
|---|
| 1564 | mso-level-number-position:left; |
|---|
| 1565 | text-indent:-.25in;} |
|---|
| 1566 | @list l14:level7 |
|---|
| 1567 | {mso-level-tab-stop:3.5in; |
|---|
| 1568 | mso-level-number-position:left; |
|---|
| 1569 | text-indent:-.25in;} |
|---|
| 1570 | @list l14:level8 |
|---|
| 1571 | {mso-level-tab-stop:4.0in; |
|---|
| 1572 | mso-level-number-position:left; |
|---|
| 1573 | text-indent:-.25in;} |
|---|
| 1574 | @list l14:level9 |
|---|
| 1575 | {mso-level-tab-stop:4.5in; |
|---|
| 1576 | mso-level-number-position:left; |
|---|
| 1577 | text-indent:-.25in;} |
|---|
| 1578 | @list l15 |
|---|
| 1579 | {mso-list-id:1326516832; |
|---|
| 1580 | mso-list-type:hybrid; |
|---|
| 1581 | mso-list-template-ids:1433942448 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1582 | @list l15:level1 |
|---|
| 1583 | {mso-level-tab-stop:none; |
|---|
| 1584 | mso-level-number-position:left; |
|---|
| 1585 | text-indent:-.25in;} |
|---|
| 1586 | @list l15:level2 |
|---|
| 1587 | {mso-level-tab-stop:1.0in; |
|---|
| 1588 | mso-level-number-position:left; |
|---|
| 1589 | text-indent:-.25in;} |
|---|
| 1590 | @list l15:level3 |
|---|
| 1591 | {mso-level-tab-stop:1.5in; |
|---|
| 1592 | mso-level-number-position:left; |
|---|
| 1593 | text-indent:-.25in;} |
|---|
| 1594 | @list l15:level4 |
|---|
| 1595 | {mso-level-tab-stop:2.0in; |
|---|
| 1596 | mso-level-number-position:left; |
|---|
| 1597 | text-indent:-.25in;} |
|---|
| 1598 | @list l15:level5 |
|---|
| 1599 | {mso-level-tab-stop:2.5in; |
|---|
| 1600 | mso-level-number-position:left; |
|---|
| 1601 | text-indent:-.25in;} |
|---|
| 1602 | @list l15:level6 |
|---|
| 1603 | {mso-level-tab-stop:3.0in; |
|---|
| 1604 | mso-level-number-position:left; |
|---|
| 1605 | text-indent:-.25in;} |
|---|
| 1606 | @list l15:level7 |
|---|
| 1607 | {mso-level-tab-stop:3.5in; |
|---|
| 1608 | mso-level-number-position:left; |
|---|
| 1609 | text-indent:-.25in;} |
|---|
| 1610 | @list l15:level8 |
|---|
| 1611 | {mso-level-tab-stop:4.0in; |
|---|
| 1612 | mso-level-number-position:left; |
|---|
| 1613 | text-indent:-.25in;} |
|---|
| 1614 | @list l15:level9 |
|---|
| 1615 | {mso-level-tab-stop:4.5in; |
|---|
| 1616 | mso-level-number-position:left; |
|---|
| 1617 | text-indent:-.25in;} |
|---|
| 1618 | @list l16 |
|---|
| 1619 | {mso-list-id:1394309879; |
|---|
| 1620 | mso-list-template-ids:326264828;} |
|---|
| 1621 | @list l16:level1 |
|---|
| 1622 | {mso-level-tab-stop:none; |
|---|
| 1623 | mso-level-number-position:left; |
|---|
| 1624 | text-indent:-.25in;} |
|---|
| 1625 | @list l16:level2 |
|---|
| 1626 | {mso-level-number-format:alpha-lower; |
|---|
| 1627 | mso-level-tab-stop:1.0in; |
|---|
| 1628 | mso-level-number-position:left; |
|---|
| 1629 | text-indent:-.25in; |
|---|
| 1630 | mso-ansi-font-size:12.0pt; |
|---|
| 1631 | font-family:"Times New Roman","serif"; |
|---|
| 1632 | mso-ansi-font-weight:normal; |
|---|
| 1633 | mso-ansi-font-style:normal;} |
|---|
| 1634 | @list l16:level3 |
|---|
| 1635 | {mso-level-tab-stop:1.5in; |
|---|
| 1636 | mso-level-number-position:left; |
|---|
| 1637 | text-indent:-.25in;} |
|---|
| 1638 | @list l16:level4 |
|---|
| 1639 | {mso-level-number-format:alpha-lower; |
|---|
| 1640 | mso-level-tab-stop:2.0in; |
|---|
| 1641 | mso-level-number-position:left; |
|---|
| 1642 | text-indent:-.25in;} |
|---|
| 1643 | @list l16:level5 |
|---|
| 1644 | {mso-level-tab-stop:2.5in; |
|---|
| 1645 | mso-level-number-position:left; |
|---|
| 1646 | text-indent:-.25in;} |
|---|
| 1647 | @list l16:level6 |
|---|
| 1648 | {mso-level-tab-stop:3.0in; |
|---|
| 1649 | mso-level-number-position:left; |
|---|
| 1650 | text-indent:-.25in;} |
|---|
| 1651 | @list l16:level7 |
|---|
| 1652 | {mso-level-tab-stop:3.5in; |
|---|
| 1653 | mso-level-number-position:left; |
|---|
| 1654 | text-indent:-.25in;} |
|---|
| 1655 | @list l16:level8 |
|---|
| 1656 | {mso-level-tab-stop:4.0in; |
|---|
| 1657 | mso-level-number-position:left; |
|---|
| 1658 | text-indent:-.25in;} |
|---|
| 1659 | @list l16:level9 |
|---|
| 1660 | {mso-level-tab-stop:4.5in; |
|---|
| 1661 | mso-level-number-position:left; |
|---|
| 1662 | text-indent:-.25in;} |
|---|
| 1663 | @list l17 |
|---|
| 1664 | {mso-list-id:1602683002; |
|---|
| 1665 | mso-list-type:hybrid; |
|---|
| 1666 | mso-list-template-ids:120980256 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1667 | @list l17:level1 |
|---|
| 1668 | {mso-level-tab-stop:none; |
|---|
| 1669 | mso-level-number-position:left; |
|---|
| 1670 | text-indent:-.25in;} |
|---|
| 1671 | @list l17:level2 |
|---|
| 1672 | {mso-level-number-format:alpha-lower; |
|---|
| 1673 | mso-level-tab-stop:none; |
|---|
| 1674 | mso-level-number-position:left; |
|---|
| 1675 | text-indent:-.25in;} |
|---|
| 1676 | @list l17:level3 |
|---|
| 1677 | {mso-level-tab-stop:1.5in; |
|---|
| 1678 | mso-level-number-position:left; |
|---|
| 1679 | text-indent:-.25in;} |
|---|
| 1680 | @list l17:level4 |
|---|
| 1681 | {mso-level-tab-stop:2.0in; |
|---|
| 1682 | mso-level-number-position:left; |
|---|
| 1683 | text-indent:-.25in;} |
|---|
| 1684 | @list l17:level5 |
|---|
| 1685 | {mso-level-tab-stop:2.5in; |
|---|
| 1686 | mso-level-number-position:left; |
|---|
| 1687 | text-indent:-.25in;} |
|---|
| 1688 | @list l17:level6 |
|---|
| 1689 | {mso-level-tab-stop:3.0in; |
|---|
| 1690 | mso-level-number-position:left; |
|---|
| 1691 | text-indent:-.25in;} |
|---|
| 1692 | @list l17:level7 |
|---|
| 1693 | {mso-level-tab-stop:3.5in; |
|---|
| 1694 | mso-level-number-position:left; |
|---|
| 1695 | text-indent:-.25in;} |
|---|
| 1696 | @list l17:level8 |
|---|
| 1697 | {mso-level-tab-stop:4.0in; |
|---|
| 1698 | mso-level-number-position:left; |
|---|
| 1699 | text-indent:-.25in;} |
|---|
| 1700 | @list l17:level9 |
|---|
| 1701 | {mso-level-tab-stop:4.5in; |
|---|
| 1702 | mso-level-number-position:left; |
|---|
| 1703 | text-indent:-.25in;} |
|---|
| 1704 | @list l18 |
|---|
| 1705 | {mso-list-id:1669404025; |
|---|
| 1706 | mso-list-type:hybrid; |
|---|
| 1707 | mso-list-template-ids:-1814001090 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
|---|
| 1708 | @list l18:level1 |
|---|
| 1709 | {mso-level-number-format:alpha-lower; |
|---|
| 1710 | mso-level-tab-stop:none; |
|---|
| 1711 | mso-level-number-position:left; |
|---|
| 1712 | margin-left:1.0in; |
|---|
| 1713 | text-indent:-.25in; |
|---|
| 1714 | mso-ansi-font-weight:normal;} |
|---|
| 1715 | @list l18:level2 |
|---|
| 1716 | {mso-level-tab-stop:1.0in; |
|---|
| 1717 | mso-level-number-position:left; |
|---|
| 1718 | text-indent:-.25in;} |
|---|
| 1719 | @list l18:level3 |
|---|
| 1720 | {mso-level-tab-stop:112.5pt; |
|---|
| 1721 | mso-level-number-position:left; |
|---|
| 1722 | margin-left:112.5pt; |
|---|
| 1723 | text-indent:-.25in;} |
|---|
| 1724 | @list l18:level4 |
|---|
| 1725 | {mso-level-tab-stop:2.0in; |
|---|
| 1726 | mso-level-number-position:left; |
|---|
| 1727 | text-indent:-.25in;} |
|---|
| 1728 | @list l18:level5 |
|---|
| 1729 | {mso-level-tab-stop:2.5in; |
|---|
| 1730 | mso-level-number-position:left; |
|---|
| 1731 | text-indent:-.25in;} |
|---|
| 1732 | @list l18:level6 |
|---|
| 1733 | {mso-level-tab-stop:3.0in; |
|---|
| 1734 | mso-level-number-position:left; |
|---|
| 1735 | text-indent:-.25in;} |
|---|
| 1736 | @list l18:level7 |
|---|
| 1737 | {mso-level-tab-stop:3.5in; |
|---|
| 1738 | mso-level-number-position:left; |
|---|
| 1739 | text-indent:-.25in;} |
|---|
| 1740 | @list l18:level8 |
|---|
| 1741 | {mso-level-tab-stop:4.0in; |
|---|
| 1742 | mso-level-number-position:left; |
|---|
| 1743 | text-indent:-.25in;} |
|---|
| 1744 | @list l18:level9 |
|---|
| 1745 | {mso-level-tab-stop:4.5in; |
|---|
| 1746 | mso-level-number-position:left; |
|---|
| 1747 | text-indent:-.25in;} |
|---|
| 1748 | @list l19 |
|---|
| 1749 | {mso-list-id:1753089587; |
|---|
| 1750 | mso-list-template-ids:1555050902;} |
|---|
| 1751 | @list l19:level1 |
|---|
| 1752 | {mso-level-tab-stop:none; |
|---|
| 1753 | mso-level-number-position:left; |
|---|
| 1754 | text-indent:-.25in;} |
|---|
| 1755 | @list l19:level2 |
|---|
| 1756 | {mso-level-tab-stop:1.0in; |
|---|
| 1757 | mso-level-number-position:left; |
|---|
| 1758 | text-indent:-.25in;} |
|---|
| 1759 | @list l19:level3 |
|---|
| 1760 | {mso-level-tab-stop:1.5in; |
|---|
| 1761 | mso-level-number-position:left; |
|---|
| 1762 | text-indent:-.25in;} |
|---|
| 1763 | @list l19:level4 |
|---|
| 1764 | {mso-level-tab-stop:2.0in; |
|---|
| 1765 | mso-level-number-position:left; |
|---|
| 1766 | text-indent:-.25in;} |
|---|
| 1767 | @list l19:level5 |
|---|
| 1768 | {mso-level-tab-stop:2.5in; |
|---|
| 1769 | mso-level-number-position:left; |
|---|
| 1770 | text-indent:-.25in;} |
|---|
| 1771 | @list l19:level6 |
|---|
| 1772 | {mso-level-tab-stop:3.0in; |
|---|
| 1773 | mso-level-number-position:left; |
|---|
| 1774 | text-indent:-.25in;} |
|---|
| 1775 | @list l19:level7 |
|---|
| 1776 | {mso-level-tab-stop:3.5in; |
|---|
| 1777 | mso-level-number-position:left; |
|---|
| 1778 | text-indent:-.25in;} |
|---|
| 1779 | @list l19:level8 |
|---|
| 1780 | {mso-level-tab-stop:4.0in; |
|---|
| 1781 | mso-level-number-position:left; |
|---|
| 1782 | text-indent:-.25in;} |
|---|
| 1783 | @list l19:level9 |
|---|
| 1784 | {mso-level-tab-stop:4.5in; |
|---|
| 1785 | mso-level-number-position:left; |
|---|
| 1786 | text-indent:-.25in;} |
|---|
| 1787 | @list l20 |
|---|
| 1788 | {mso-list-id:2029942403; |
|---|
| 1789 | mso-list-template-ids:1555050902;} |
|---|
| 1790 | @list l20:level1 |
|---|
| 1791 | {mso-level-tab-stop:none; |
|---|
| 1792 | mso-level-number-position:left; |
|---|
| 1793 | text-indent:-.25in;} |
|---|
| 1794 | @list l20:level2 |
|---|
| 1795 | {mso-level-tab-stop:1.0in; |
|---|
| 1796 | mso-level-number-position:left; |
|---|
| 1797 | text-indent:-.25in;} |
|---|
| 1798 | @list l20:level3 |
|---|
| 1799 | {mso-level-tab-stop:1.5in; |
|---|
| 1800 | mso-level-number-position:left; |
|---|
| 1801 | text-indent:-.25in;} |
|---|
| 1802 | @list l20:level4 |
|---|
| 1803 | {mso-level-tab-stop:2.0in; |
|---|
| 1804 | mso-level-number-position:left; |
|---|
| 1805 | text-indent:-.25in;} |
|---|
| 1806 | @list l20:level5 |
|---|
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| 1893 | mso-level-number-position:left; |
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| 1894 | text-indent:-.25in;} |
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| 1896 | {mso-level-tab-stop:3.5in; |
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| 1902 | text-indent:-.25in;} |
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| 1906 | text-indent:-.25in;} |
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| 1907 | ol |
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| 1908 | {margin-bottom:0in;} |
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| 1909 | ul |
|---|
| 1910 | {margin-bottom:0in;} |
|---|
| 1911 | --> |
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| 1912 | </style> |
|---|
| 1913 | <!--[if gte mso 10]> |
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| 1914 | <style> |
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| 1915 | /* Style Definitions */ |
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| 1916 | table.MsoNormalTable |
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| 1917 | {mso-style-name:"Table Normal"; |
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| 1918 | mso-tstyle-rowband-size:0; |
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| 1919 | mso-tstyle-colband-size:0; |
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| 1926 | mso-pagination:widow-orphan; |
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| 1927 | font-size:10.0pt; |
|---|
| 1928 | font-family:"Times New Roman","serif";} |
|---|
| 1929 | </style> |
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| 1930 | <![endif]--> |
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| 1931 | <link href=gsasIIfav.png rel="SHORTCUT ICON"> |
|---|
| 1932 | <!--[if gte mso 9]><xml> |
|---|
| 1933 | <o:shapedefaults v:ext="edit" spidmax="1027"/> |
|---|
| 1934 | </xml><![endif]--><!--[if gte mso 9]><xml> |
|---|
| 1935 | <o:shapelayout v:ext="edit"> |
|---|
| 1936 | <o:idmap v:ext="edit" data="1"/> |
|---|
| 1937 | </o:shapelayout></xml><![endif]--> |
|---|
| 1938 | </head> |
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| 1939 | |
|---|
| 1940 | <body lang=EN-US link=blue vlink=purple style='tab-interval:.5in'> |
|---|
| 1941 | |
|---|
| 1942 | <div class=WordSection1> |
|---|
| 1943 | |
|---|
| 1944 | <h1><!--[if gte vml 1]><v:shapetype id="_x0000_t75" coordsize="21600,21600" |
|---|
| 1945 | o:spt="75" o:preferrelative="t" path="m@4@5l@4@11@9@11@9@5xe" filled="f" |
|---|
| 1946 | stroked="f"> |
|---|
| 1947 | <v:stroke joinstyle="miter"/> |
|---|
| 1948 | <v:formulas> |
|---|
| 1949 | <v:f eqn="if lineDrawn pixelLineWidth 0"/> |
|---|
| 1950 | <v:f eqn="sum @0 1 0"/> |
|---|
| 1951 | <v:f eqn="sum 0 0 @1"/> |
|---|
| 1952 | <v:f eqn="prod @2 1 2"/> |
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|---|
| 1959 | <v:f eqn="prod @7 21600 pixelHeight"/> |
|---|
| 1960 | <v:f eqn="sum @10 21600 0"/> |
|---|
| 1961 | </v:formulas> |
|---|
| 1962 | <v:path o:extrusionok="f" gradientshapeok="t" o:connecttype="rect"/> |
|---|
| 1963 | <o:lock v:ext="edit" aspectratio="t"/> |
|---|
| 1964 | </v:shapetype><v:shape id="Picture_x0020_2" o:spid="_x0000_s1026" type="#_x0000_t75" |
|---|
| 1965 | alt="Description: Description: Description: Description: Description: Description: Description: Description: Description: Description: GSAS-II logo" |
|---|
| 1966 | style='position:absolute;margin-left:44.8pt;margin-top:0;width:96pt;height:96pt; |
|---|
| 1967 | z-index:251657728;visibility:visible;mso-wrap-style:square; |
|---|
| 1968 | mso-width-percent:0;mso-height-percent:0;mso-wrap-distance-left:0; |
|---|
| 1969 | mso-wrap-distance-top:0;mso-wrap-distance-right:0;mso-wrap-distance-bottom:0; |
|---|
| 1970 | mso-position-horizontal:right;mso-position-horizontal-relative:text; |
|---|
| 1971 | mso-position-vertical:absolute;mso-position-vertical-relative:line; |
|---|
| 1972 | mso-width-percent:0;mso-height-percent:0;mso-width-relative:page; |
|---|
| 1973 | mso-height-relative:page' o:allowoverlap="f"> |
|---|
| 1974 | <v:imagedata src="gsas2logo.png"/> |
|---|
| 1975 | <w:wrap type="square" anchory="line"/> |
|---|
| 1976 | </v:shape><![endif]--><![if !vml]><img width=128 height=128 src=gsas2logo.png |
|---|
| 1977 | align=right |
|---|
| 1978 | alt="Description: Description: Description: Description: Description: Description: Description: Description: Description: Description: GSAS-II logo" |
|---|
| 1979 | v:shapes="Picture_x0020_2"><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>Help |
|---|
| 1980 | for GSAS-II<o:p></o:p></span></h1> |
|---|
| 1981 | |
|---|
| 1982 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 1983 | is where to find help on various GSAS-II windows and plots. Note that GSAS-II |
|---|
| 1984 | operates with four windows: the main <a href="#Data_tree">GSAS-II data tree</a> |
|---|
| 1985 | window, which provides a hierarchical view of the current project; the <a |
|---|
| 1986 | href="#Data_Frame">GSAS-II data editing</a> window, which shows the contents of |
|---|
| 1987 | a particular section of the project, where values can be examined and changed; |
|---|
| 1988 | the <a href="#Plots">GSAS-II Plots</a> window, which shows graphical |
|---|
| 1989 | representations of the results; and the console which has printout information |
|---|
| 1990 | that can be selected, cut & pasted into a document. <o:p></o:p></span></p> |
|---|
| 1991 | |
|---|
| 1992 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
|---|
| 1993 | |
|---|
| 1994 | <h2><a name=Tutorials><strong>GSAS-II tutorials</strong></a><strong>:<o:p></o:p></strong></h2> |
|---|
| 1995 | |
|---|
| 1996 | <p class=MsoNormal><strong><a href="Starting%20GSAS.htm"><span |
|---|
| 1997 | style='font-weight:normal'>Starting GSAS-II</span></a><o:p></o:p></strong></p> |
|---|
| 1998 | |
|---|
| 1999 | <p class=MsoNormal><strong><a |
|---|
| 2000 | href="Calibration%20of%20an%20area%20detector%20in%20GSAS.htm"><span |
|---|
| 2001 | style='font-weight:normal'>2-D Image calibration</span></a><o:p></o:p></strong></p> |
|---|
| 2002 | |
|---|
| 2003 | <p class=MsoNormal><strong><a |
|---|
| 2004 | href="Integration%20of%20area%20detector%20data%20in%20GSAS.htm"><span |
|---|
| 2005 | style='font-weight:normal'>2-D Image integration</span></a><o:p></o:p></strong></p> |
|---|
| 2006 | |
|---|
| 2007 | <p class=MsoNormal><strong><a href="Fit%20Peaks.htm"><span style='font-weight: |
|---|
| 2008 | normal'>Powder pattern peak picking, fitting and indexing</span></a><o:p></o:p></strong></p> |
|---|
| 2009 | |
|---|
| 2010 | <p class=MsoNormal><strong><a href="Laboratory%20X.htm"><span style='font-weight: |
|---|
| 2011 | normal'>Lab X-ray powder pattern Rietveld refinement</span></a><o:p></o:p></strong></p> |
|---|
| 2012 | |
|---|
| 2013 | <p class=MsoNormal><strong><a href="Neutron%20CW%20Powder%20Data.htm"><span |
|---|
| 2014 | style='font-weight:normal'>CW Neutron powder pattern Rietveld refinement with |
|---|
| 2015 | constraints</span></a><o:p></o:p></strong></p> |
|---|
| 2016 | |
|---|
| 2017 | <p class=MsoNormal><strong><a href="Combined%20refinement.htm"><span |
|---|
| 2018 | style='font-weight:normal'>Combined neutron x-ray Rietveld refinement and |
|---|
| 2019 | Fourier maps</span></a><o:p></o:p></strong></p> |
|---|
| 2020 | |
|---|
| 2021 | <p class=MsoNormal><strong>Synchrotron X-ray powder pattern Rietveld refinement<o:p></o:p></strong></p> |
|---|
| 2022 | |
|---|
| 2023 | <p class=MsoNormal><strong>Charge flipping structure solution (future)<o:p></o:p></strong></p> |
|---|
| 2024 | |
|---|
| 2025 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 2026 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2027 | |
|---|
| 2028 | <hr size=2 width="100%" align=center> |
|---|
| 2029 | |
|---|
| 2030 | </span></div> |
|---|
| 2031 | |
|---|
| 2032 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 2033 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2034 | |
|---|
| 2035 | <hr size=2 width="100%" align=center> |
|---|
| 2036 | |
|---|
| 2037 | </span></div> |
|---|
| 2038 | |
|---|
| 2039 | <h2><a name="Data_tree"></a><span style='mso-fareast-font-family:"Times New Roman"'>1. |
|---|
| 2040 | GSAS-II data tree<o:p></o:p></span></h2> |
|---|
| 2041 | |
|---|
| 2042 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2043 | is a hierarchical view of the data items in your GSAS-II project (name.gpx). |
|---|
| 2044 | Clicking on any item in the tree opens a window where information in that item |
|---|
| 2045 | can be viewed or edited. For example, the <a href="#Sample_Parameters">"Sample |
|---|
| 2046 | Parameters"</a> item under a ‘PWDR’ entry contains information |
|---|
| 2047 | about how data were collected, such as the sample temperature <a |
|---|
| 2048 | href="#Sample_Parameters">(see below)</a>. The arrow keys (up & down) move |
|---|
| 2049 | the selection to successive entries in the data tree; both the data window and |
|---|
| 2050 | the associated plot (if any) will change.<o:p></o:p></span></p> |
|---|
| 2051 | |
|---|
| 2052 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h4> |
|---|
| 2053 | |
|---|
| 2054 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
|---|
| 2055 | menus associated with this window provide access to many features of GSAS-II, |
|---|
| 2056 | as outlined below: <o:p></o:p></span></p> |
|---|
| 2057 | |
|---|
| 2058 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
|---|
| 2059 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2060 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 2061 | ‘<b style='mso-bidi-font-weight:normal'>File</b>’ – </p> |
|---|
| 2062 | |
|---|
| 2063 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2064 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2065 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2066 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2067 | style='mso-bidi-font-weight:normal'>Open project…</b> - Open a previously |
|---|
| 2068 | saved GSAS-II project file (name.gpx). If you currently have a project file |
|---|
| 2069 | open, you are asked if it is OK to over write it; Cancel will cancel the |
|---|
| 2070 | process. <b style='mso-bidi-font-weight:normal'>NB</b>: you may open a backup <span |
|---|
| 2071 | class=SpellE>gpx</span> file (e.g. name.bak3.gpx) to recover a previous version |
|---|
| 2072 | of your project. Remember to <b style='mso-bidi-font-weight:normal'>Save As</b>… |
|---|
| 2073 | to e.g. name.gpx to overwrite the current version. Otherwise you may get |
|---|
| 2074 | backups of your backup file (e.g. name.bak3.bak0.gpx, etc.).</p> |
|---|
| 2075 | |
|---|
| 2076 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2077 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2078 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2079 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2080 | style='mso-bidi-font-weight:normal'>Save project</b> – Save the current |
|---|
| 2081 | project. If a file name is shown after ‘Loaded Data:’ in the data |
|---|
| 2082 | tree<span style='mso-fareast-font-family:"Times New Roman"'>, it will be saved |
|---|
| 2083 | there. Otherwise, you will be prompted for a new name in a file dialog (you may |
|---|
| 2084 | change directory as well). If the file exists, you will be asked if it OK to |
|---|
| 2085 | overwrite.</span></p> |
|---|
| 2086 | |
|---|
| 2087 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2088 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2089 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2090 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2091 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Save |
|---|
| 2092 | As…</span></b><span style='mso-fareast-font-family:"Times New Roman"'> - |
|---|
| 2093 | Save the current project to a new file. A file dialog will be shown to enter |
|---|
| 2094 | the name (and change directory if desired). If the file exists, you will be |
|---|
| 2095 | asked if it OK to overwrite.</span></p> |
|---|
| 2096 | |
|---|
| 2097 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2098 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2099 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2100 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2101 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Close |
|---|
| 2102 | project</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2103 | – Close the current project; you will be asked if you want to save it |
|---|
| 2104 | first.</span></p> |
|---|
| 2105 | |
|---|
| 2106 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2107 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2108 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 2109 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2110 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Exit</span></b><span |
|---|
| 2111 | style='mso-fareast-font-family:"Times New Roman"'> – Exit the GSAS-II |
|---|
| 2112 | program; if there is a current project you will be asked if you want to save it |
|---|
| 2113 | first. Pressing the red X in the upper right (Windows) also exits (no save |
|---|
| 2114 | option) GSAS-II; useful for escaping from GSAS-II if needed.</span></p> |
|---|
| 2115 | |
|---|
| 2116 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
|---|
| 2117 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2118 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 2119 | ‘<b style='mso-bidi-font-weight:normal'>Data</b>’ – </p> |
|---|
| 2120 | |
|---|
| 2121 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2122 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2123 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2124 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2125 | style='mso-bidi-font-weight:normal'>Read powder data…</b> - Read in |
|---|
| 2126 | powder diffraction patterns (multiple patterns can be selected). GSAS-II can |
|---|
| 2127 | read most of the old GSAS powder format files with the position in <span |
|---|
| 2128 | class=SpellE>centidegrees</span> 2-theta. It can also read “<span |
|---|
| 2129 | class=SpellE>xye</span>” format files used by <span class=SpellE>topas</span> |
|---|
| 2130 | where the position is in degrees 2-theta. As each file is read, an old GSAS |
|---|
| 2131 | style “instrument parameter file” is searched for; if not found a <span |
|---|
| 2132 | class=SpellE>CuK</span><span style='font-family:Symbol'>a</span> laboratory |
|---|
| 2133 | data set is assumed. </p> |
|---|
| 2134 | |
|---|
| 2135 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2136 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2137 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2138 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2139 | style='mso-bidi-font-weight:normal'>Read image data…</b> - Read in 2-D |
|---|
| 2140 | powder diffraction images (multiple patterns can be selected). GSAS-II can read |
|---|
| 2141 | many different image file formats including MAR345 files, Quantum ADSC files, |
|---|
| 2142 | and tiff files from Perkin-Elmer, Pilatus, and GE. Although many of these |
|---|
| 2143 | formats have data fields that should contain relevant information for the |
|---|
| 2144 | exposure (e.g. wavelength), these are rarely filled in correctly by the data |
|---|
| 2145 | acquisition software. Thus, you should have separately noted this information |
|---|
| 2146 | as it will be needed</p> |
|---|
| 2147 | |
|---|
| 2148 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2149 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2150 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2151 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2152 | style='mso-bidi-font-weight:normal'>Read Powder Pattern Peaks…</b> - Read |
|---|
| 2153 | in a list of powder pattern peak positions as either a d-spacing table or a set |
|---|
| 2154 | of 2<span style='font-family:Symbol'>Q</span> positions; these can be used in |
|---|
| 2155 | GSAS-II powder pattern indexing. </p> |
|---|
| 2156 | |
|---|
| 2157 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2158 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2159 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2160 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2161 | style='mso-bidi-font-weight:normal'>Read single crystal data…</b> - </p> |
|---|
| 2162 | |
|---|
| 2163 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2164 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2165 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 2166 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2167 | style='mso-bidi-font-weight:normal'>Sum powder data</b> - </p> |
|---|
| 2168 | |
|---|
| 2169 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2170 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2171 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
|---|
| 2172 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2173 | style='mso-bidi-font-weight:normal'>Sum image data</b> - </p> |
|---|
| 2174 | |
|---|
| 2175 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2176 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2177 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
|---|
| 2178 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2179 | style='mso-bidi-font-weight:normal'>Add phase</b> – This begins the |
|---|
| 2180 | creation of a new phase in the data tree (under Phases). You are first prompted |
|---|
| 2181 | in a dialog box for a name to be assigned to the new phase. Then the <b |
|---|
| 2182 | style='mso-bidi-font-weight:normal'><a href="#General">General</a></b> tab is |
|---|
| 2183 | opened for this phase; you should first select the phase type, enter the space |
|---|
| 2184 | group symbol and then lattice parameters. Note that nonstandard space group |
|---|
| 2185 | symbols are permitted; there must be spaces between the axial fields (e.g. use |
|---|
| 2186 | ‘P n a 21’ not ‘Pna21’).</p> |
|---|
| 2187 | |
|---|
| 2188 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2189 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2190 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
|---|
| 2191 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2192 | style='mso-bidi-font-weight:normal'>Delete phase</b> – This will remove a |
|---|
| 2193 | phase from the data tree. A dialog box will present the list of phases; pick |
|---|
| 2194 | one (or more) to delete.</p> |
|---|
| 2195 | |
|---|
| 2196 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2197 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2198 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
|---|
| 2199 | style='font:7.0pt "Times New Roman"'> |
|---|
| 2200 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Rename |
|---|
| 2201 | data</b> – This might be a bad idea!!</p> |
|---|
| 2202 | |
|---|
| 2203 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2204 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2205 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
|---|
| 2206 | style='font:7.0pt "Times New Roman"'> |
|---|
| 2207 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Delete |
|---|
| 2208 | data</b> – This will remove an item from the data tree. A dialog box with |
|---|
| 2209 | a list of choices is presented.</p> |
|---|
| 2210 | |
|---|
| 2211 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
|---|
| 2212 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2213 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 2214 | ‘<b style='mso-bidi-font-weight:normal'>Calculate</b>’ – </p> |
|---|
| 2215 | |
|---|
| 2216 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2217 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2218 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2219 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2220 | style='mso-bidi-font-weight:normal'>Make new PDFs</b> – This creates the |
|---|
| 2221 | pair distribution function (PDF) controls for each powder pattern selected in |
|---|
| 2222 | the dialog box. See <b style='mso-bidi-font-weight:normal'><span |
|---|
| 2223 | style='color:#4F81BD;mso-themecolor:accent1'><a href="#PDF_Controls">PDF |
|---|
| 2224 | Controls</a></span></b> for further directions.</p> |
|---|
| 2225 | |
|---|
| 2226 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2227 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2228 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2229 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2230 | style='mso-bidi-font-weight:normal'>View LS <span class=SpellE>parms</span></b> |
|---|
| 2231 | – This shows a dialog box with all the parameters for your project; those |
|---|
| 2232 | to be refined are flagged ‘True’, otherwise ‘False’. Blanks |
|---|
| 2233 | indicate parameters that are not <span class=SpellE>refinable</span>. The total |
|---|
| 2234 | number of refined parameters is also shown at the top of the list. The value of |
|---|
| 2235 | each parameter is also given. The parameter names are of the form ‘p<span |
|---|
| 2236 | class=GramE>:h:name:id’</span> where ‘p’ is the phase index, |
|---|
| 2237 | ‘h’ is the histogram index and ‘id’ is the item index |
|---|
| 2238 | (if needed). Indexes all begin with ‘0’ (zero). Note that for atom |
|---|
| 2239 | positions the value is not a <span class=SpellE>refinable</span> parameter, but |
|---|
| 2240 | the shift in the value is. Position names are, e.g. ‘0:<span class=GramE>:Ax:0’</span> |
|---|
| 2241 | for the x-position of the <span class=SpellE>zeroth</span> atom in the <span |
|---|
| 2242 | class=SpellE>zeroth</span> phase while shift names have a ‘d’ in |
|---|
| 2243 | then, e.g. ‘0::dAx:0’. </p> |
|---|
| 2244 | |
|---|
| 2245 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2246 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2247 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2248 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2249 | style='mso-bidi-font-weight:normal'>Refine</b> – This performs the |
|---|
| 2250 | refinement (Pawley/Rietveld or single crystal) according to the controls set in |
|---|
| 2251 | the <b style='mso-bidi-font-weight:normal'><a href="#Controls">Controls</a></b> |
|---|
| 2252 | data tree item.</p> |
|---|
| 2253 | |
|---|
| 2254 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2255 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2256 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2257 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2258 | style='mso-bidi-font-weight:normal'>Sequential refine</b> – This starts a |
|---|
| 2259 | sequential refinement with the data sets selected in the <b style='mso-bidi-font-weight: |
|---|
| 2260 | normal'><a href="#Controls">Controls</a></b> data tree item.</p> |
|---|
| 2261 | |
|---|
| 2262 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
|---|
| 2263 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 2264 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 2265 | ‘<b style='mso-bidi-font-weight:normal'>Import</b>’ – </p> |
|---|
| 2266 | |
|---|
| 2267 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2268 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2269 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2270 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2271 | style='mso-bidi-font-weight:normal'>Import Phase (specific) - </b></p> |
|---|
| 2272 | |
|---|
| 2273 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
|---|
| 2274 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
|---|
| 2275 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2276 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2277 | style='mso-bidi-font-weight:normal'>Import Phase GSAS.EXP… - </b>This |
|---|
| 2278 | reads one phase from a GSAS experiment file (name.EXP). The file name is found |
|---|
| 2279 | in a directory dialog; you can change directories as needed. Only .EXP (or |
|---|
| 2280 | .exp) file names are shown. If the selected file has more than one phase, a |
|---|
| 2281 | dialog is shown with the choices; only one can be chosen. If you want more than |
|---|
| 2282 | one, redo the <b style='mso-bidi-font-weight:normal'>Import Phase GSAS.EXP</b> |
|---|
| 2283 | command. After selecting a phase, a dialog box is shown with the proposed phase |
|---|
| 2284 | name. You can change it if desired.</p> |
|---|
| 2285 | |
|---|
| 2286 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
|---|
| 2287 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
|---|
| 2288 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2289 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2290 | style='mso-bidi-font-weight:normal'>Import Phase PDB…</b> - This reads |
|---|
| 2291 | the macromolecular phase information from a Protein Data Base file (name.PDB or |
|---|
| 2292 | name.ENT). The file name is found in a directory dialog; you can change |
|---|
| 2293 | directories as needed. Only .PDB or .ENT file names are shown. Be careful that |
|---|
| 2294 | the space group symbol on the ‘CRYST1’ record in the PDB file follows |
|---|
| 2295 | the GSAS-II conventions (e.g. with spaces between axial fields). A dialog box |
|---|
| 2296 | is shown with the proposed phase name. You can change it if desired.</p> |
|---|
| 2297 | |
|---|
| 2298 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
|---|
| 2299 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
|---|
| 2300 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2301 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2302 | style='mso-bidi-font-weight:normal'>Import Phase CIF…</b> This reads one |
|---|
| 2303 | phase from a Crystallographic Information File (name.CIF). The file name is |
|---|
| 2304 | found in a directory dialog; you can change directories as needed. Only .CIF |
|---|
| 2305 | (or .<span class=SpellE>cif</span>) file names are shown. If the selected file |
|---|
| 2306 | has more than one phase, a dialog is shown with the choices; only one can be |
|---|
| 2307 | chosen. If you want more than one, redo the <b style='mso-bidi-font-weight: |
|---|
| 2308 | normal'>Import Phase CIF</b> command. After selecting a phase, a dialog box is |
|---|
| 2309 | shown with the proposed phase name. You can change it if desired.</p> |
|---|
| 2310 | |
|---|
| 2311 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
|---|
| 2312 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
|---|
| 2313 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 2314 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2315 | style='mso-bidi-font-weight:normal'>Import Phase GSAS-II <span class=SpellE>gpx</span>…</b> |
|---|
| 2316 | This reads one phase from a GSAS-II project file (name.GPX). The file name is |
|---|
| 2317 | found in a directory dialog; you can change directories as needed. Only .GPX |
|---|
| 2318 | (or .<span class=SpellE>gpx</span>) file names are shown. If the selected file |
|---|
| 2319 | has more than one phase, a dialog is shown with the choices; only one can be |
|---|
| 2320 | chosen. If you want more than one, redo the <b style='mso-bidi-font-weight: |
|---|
| 2321 | normal'>Import Phase GSAS-II <span class=SpellE>gpx</span></b> command. After |
|---|
| 2322 | selecting a phase, a dialog box is shown with the proposed phase name. You can |
|---|
| 2323 | change it if desired.</p> |
|---|
| 2324 | |
|---|
| 2325 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2326 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2327 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2328 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2329 | style='mso-bidi-font-weight:normal'>Import Powder Pattern…</b> - </p> |
|---|
| 2330 | |
|---|
| 2331 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2332 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2333 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2334 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2335 | style='mso-bidi-font-weight:normal'>Import HKLs…</b> - </p> |
|---|
| 2336 | |
|---|
| 2337 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
|---|
| 2338 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
|---|
| 2339 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 2340 | ‘<b style='mso-bidi-font-weight:normal'>Export</b>’ –</p> |
|---|
| 2341 | |
|---|
| 2342 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2343 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2344 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2345 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2346 | style='mso-bidi-font-weight:normal'>Export Powder Patterns…</b> - </p> |
|---|
| 2347 | |
|---|
| 2348 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2349 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2350 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2351 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2352 | style='mso-bidi-font-weight:normal'>Export All Peak Lists…</b> - </p> |
|---|
| 2353 | |
|---|
| 2354 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2355 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2356 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2357 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2358 | style='mso-bidi-font-weight:normal'>Export HKLs…</b> - </p> |
|---|
| 2359 | |
|---|
| 2360 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2361 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2362 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2363 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2364 | style='mso-bidi-font-weight:normal'>Export PDF…</b> - </p> |
|---|
| 2365 | |
|---|
| 2366 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2367 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2368 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 2369 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2370 | style='mso-bidi-font-weight:normal'>Export Phase…</b> - </p> |
|---|
| 2371 | |
|---|
| 2372 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 2373 | text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
|---|
| 2374 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
|---|
| 2375 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2376 | style='mso-bidi-font-weight:normal'>Export CIF…</b> - </p> |
|---|
| 2377 | |
|---|
| 2378 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 2379 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2380 | |
|---|
| 2381 | <hr size=2 width="100%" align=center> |
|---|
| 2382 | |
|---|
| 2383 | </span></div> |
|---|
| 2384 | |
|---|
| 2385 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 2386 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2387 | |
|---|
| 2388 | <hr size=2 width="100%" align=center> |
|---|
| 2389 | |
|---|
| 2390 | </span></div> |
|---|
| 2391 | |
|---|
| 2392 | <h2><a name="Data_Frame"><span style='mso-fareast-font-family:"Times New Roman"'>2. |
|---|
| 2393 | GSAS-II Data Editing Window</span></a><span style='mso-fareast-font-family: |
|---|
| 2394 | "Times New Roman"'><o:p></o:p></span></h2> |
|---|
| 2395 | |
|---|
| 2396 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Different |
|---|
| 2397 | information is displayed in the Data Editing Window, depending on which section |
|---|
| 2398 | of the <a href="#Data_tree">data tree</a> is selected. For example, clicking on |
|---|
| 2399 | the "Notebook" entry of the tree brings up the Notebook editing |
|---|
| 2400 | window described below. <o:p></o:p></span></p> |
|---|
| 2401 | |
|---|
| 2402 | <h4><a name=Notebook><span style='mso-fareast-font-family:"Times New Roman"'>Notebook</span></a><span |
|---|
| 2403 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 2404 | |
|---|
| 2405 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2406 | window provides a place for you to enter whatever text commentary you wish. |
|---|
| 2407 | Each time you enter this window, a date/time entry is provided for you. A |
|---|
| 2408 | possibly useful technique is to select a portion of the console window after a |
|---|
| 2409 | refinement completes (it will contain refinement results with residuals, new |
|---|
| 2410 | values & <span class=SpellE>esds</span>) and paste it into this Notebook |
|---|
| 2411 | window so it becomes a part of your project file.<o:p></o:p></span></p> |
|---|
| 2412 | |
|---|
| 2413 | <h4><a name=Controls><span style='mso-fareast-font-family:"Times New Roman"'>Controls</span></a><span |
|---|
| 2414 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 2415 | |
|---|
| 2416 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2417 | window provides the main controls for the major calculations in GSAS-II. At |
|---|
| 2418 | present only Refinement Controls are presented. <o:p></o:p></span></p> |
|---|
| 2419 | |
|---|
| 2420 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Two |
|---|
| 2421 | of the main refinement tools are the <span class=SpellE><span class=GramE>fortran</span></span> |
|---|
| 2422 | MINPACK <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
|---|
| 2423 | algorithms wrapped in python as provided in the <span class=SpellE>Scipy</span> |
|---|
| 2424 | package and a third one is a python version utilizing only the <span |
|---|
| 2425 | class=SpellE>numpy</span> package. The purpose is to </span>minimize the sum of |
|---|
| 2426 | the squares of M<span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2427 | nonlinear functions in N variables by a modification of the <span class=SpellE>Levenberg</span>-Marquardt |
|---|
| 2428 | algorithm. The <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
|---|
| 2429 | routines were written by </span>Burton S. <span class=SpellE>Garbow</span>, |
|---|
| 2430 | Kenneth E. <span class=SpellE>Hillstrom</span>, <span class=GramE>Jorge</span> |
|---|
| 2431 | J. <span class=GramE>More (Argonne National Laboratory, 1980).</span> The |
|---|
| 2432 | python/numpy version was developed by us based on the material in Numerical |
|---|
| 2433 | Recipes (Press, Flannery, <span class=SpellE><span class=GramE>Teulosky</span></span> |
|---|
| 2434 | & <span class=SpellE>Vetterling</span>) for the <span class=SpellE>Levenberg</span>-Marquardt |
|---|
| 2435 | algorithm.<span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></p> |
|---|
| 2436 | |
|---|
| 2437 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2438 | |
|---|
| 2439 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
|---|
| 2440 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2441 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2442 | style='mso-fareast-font-family:"Times New Roman"'>Select whether the refinement |
|---|
| 2443 | uses ‘analytic <span class=SpellE>Jacobian</span>’, ‘analytic |
|---|
| 2444 | Hessian’ or ‘numeric’ derivatives. The last is slower and |
|---|
| 2445 | perhaps a bit less accurate, but may be needed if the analytic functions are |
|---|
| 2446 | not fully developed. The <span class=SpellE>Jacobian</span> matrix is shaped N |
|---|
| 2447 | x M (parameters x observations) and is much larger than the Hessian matrix |
|---|
| 2448 | which is shaped M x M (parameters x parameters). Generally use ‘analytic |
|---|
| 2449 | Hessian’ for routine work.<o:p></o:p></span></p> |
|---|
| 2450 | |
|---|
| 2451 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
|---|
| 2452 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2453 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2454 | style='mso-fareast-font-family:"Times New Roman"'>Select ‘Min |
|---|
| 2455 | delta-M/M’ for convergence; the refinement will stop when the change in |
|---|
| 2456 | the minimization function is less than this value. Set Min delta-M/M = 1.0 to |
|---|
| 2457 | force just a single cycle to be performed. A value less than 10<sup>-4</sup> |
|---|
| 2458 | (the default) generally gives no better result. The allowed range is 10<sup>-9</sup> |
|---|
| 2459 | to 1.0.<o:p></o:p></span></p> |
|---|
| 2460 | |
|---|
| 2461 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
|---|
| 2462 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2463 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2464 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic |
|---|
| 2465 | Jacobean’ is chosen then select ‘Initial shift factor’ for |
|---|
| 2466 | the first cycle of refinement. This value is modified by the least squares |
|---|
| 2467 | routine. The allowed range is 10<sup>-5</sup> to 100. Smaller values may be |
|---|
| 2468 | needed if your initial <span class=GramE>refinement</span> trials immediately |
|---|
| 2469 | diverge, however make sure your starting parameter values are ‘reasonable’. |
|---|
| 2470 | The selected default (=1.0) normally gives good performance.<o:p></o:p></span></p> |
|---|
| 2471 | |
|---|
| 2472 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
|---|
| 2473 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 2474 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2475 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic |
|---|
| 2476 | Hessian’ is chosen then select ‘Max cycles’, the maximum |
|---|
| 2477 | number of least squares cycles to be performed. Least squares cycles are |
|---|
| 2478 | determined by the number of times a new Hessian matrix is computes; the <span |
|---|
| 2479 | class=SpellE>Levenberg</span>-Marquardt algorithm may compute the function |
|---|
| 2480 | several times between cycles as it finds the optimal value of the Marquardt |
|---|
| 2481 | coefficient. Choices are given in the pull down selection; the default is 3 |
|---|
| 2482 | cycles.<o:p></o:p></span></p> |
|---|
| 2483 | |
|---|
| 2484 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
|---|
| 2485 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
|---|
| 2486 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2487 | style='mso-fareast-font-family:"Times New Roman"'>Select data for sequential |
|---|
| 2488 | refinement; the data sets may be done in ‘reverse order’. <o:p></o:p></span></p> |
|---|
| 2489 | |
|---|
| 2490 | <h4>Covariance<span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 2491 | |
|---|
| 2492 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2493 | window is blank; the GSASII Plots window ‘<a href="#Covariance">Covariance’</a> |
|---|
| 2494 | shows a graphical representation of the variance-covariance matrix <o:p></o:p></span></p> |
|---|
| 2495 | |
|---|
| 2496 | <h4><a name=Constraints><span style='mso-fareast-font-family:"Times New Roman"'>Constraints<o:p></o:p></span></a></h4> |
|---|
| 2497 | |
|---|
| 2498 | <span style='mso-bookmark:Constraints'></span> |
|---|
| 2499 | |
|---|
| 2500 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2501 | window shows the constraints to be used in a refinement. It is organized into |
|---|
| 2502 | three tabbed pages. ‘Phase constraints’ contain those involving |
|---|
| 2503 | parameters that describe aspects of the crystalline phases to be used in the |
|---|
| 2504 | refinement (e.g. atom coordinates, thermal motion and site fraction |
|---|
| 2505 | parameters). ‘Histogram/Phase constraints’ are those which describe |
|---|
| 2506 | aspects of the pattern that depend on both the phase and the data set used in |
|---|
| 2507 | the refinement (e.g. </span><span style='font-family:Symbol;mso-fareast-font-family: |
|---|
| 2508 | "Times New Roman"'>m</span><span style='mso-fareast-font-family:"Times New Roman"'>strain |
|---|
| 2509 | and crystallite size parameters). ‘Histogram constraints’ are those |
|---|
| 2510 | that depend only on the data set (e.g. profile coefficients U<span class=GramE>,V,W,X</span> |
|---|
| 2511 | and Y).<o:p></o:p></span></p> |
|---|
| 2512 | |
|---|
| 2513 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2514 | |
|---|
| 2515 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l17 level1 lfo3'><![if !supportLists]><span |
|---|
| 2516 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2517 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2518 | style='mso-fareast-font-family:"Times New Roman"'>Select the tab for the |
|---|
| 2519 | parameter types you wish to constrain. Each will have the same possibilities in |
|---|
| 2520 | the ‘Edit menu.<o:p></o:p></span></p> |
|---|
| 2521 | |
|---|
| 2522 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l17 level1 lfo3'><![if !supportLists]><span |
|---|
| 2523 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2524 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2525 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 2526 | style='mso-bidi-font-weight:normal'>Edit</b>’ – <o:p></o:p></span></p> |
|---|
| 2527 | |
|---|
| 2528 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2529 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
|---|
| 2530 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2531 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2532 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 2533 | "Times New Roman"'>Add</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 2534 | style='mso-fareast-font-family:"Times New Roman"'> Hold</span></b><span |
|---|
| 2535 | style='mso-fareast-font-family:"Times New Roman"'> – select a parameter |
|---|
| 2536 | that you wish to remain fixed although other parameters of the same type may be |
|---|
| 2537 | selected as a group for refinement. For example, if the space group for a phase |
|---|
| 2538 | has a polar axis (e.g. the b-axis in P2<sub>1</sub>), then one atom y-parameter |
|---|
| 2539 | is arbitrary and should be selected for a Hold to keep the structure from |
|---|
| 2540 | drifting up or down the y-axis during refinement. If selected, a dialog box |
|---|
| 2541 | will appear showing the list of available parameters; select one and then OK to |
|---|
| 2542 | implement it, Cancel will cancel the operation. The held parameter will be |
|---|
| 2543 | shown in the constraint window with the keyword ‘FIXED’. A Delete |
|---|
| 2544 | button can be used to remove it.<o:p></o:p></span></p> |
|---|
| 2545 | |
|---|
| 2546 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2547 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
|---|
| 2548 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2549 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2550 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
|---|
| 2551 | equivalence</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2552 | – select a list of parameters that should have the same value (possibly |
|---|
| 2553 | with a non-unitary multiplier for some). Examples are a list of atoms with the |
|---|
| 2554 | same thermal motion <span class=SpellE>Uiso</span>, sets of profile |
|---|
| 2555 | coefficients U<span class=GramE>,V,W</span> across multiple data sets. If |
|---|
| 2556 | selected, a dialog box will appear with a list of the available parameters. |
|---|
| 2557 | Select one and press OK; a second dialog box will appear with only those |
|---|
| 2558 | parameters that can be made equivalent to the first one. Choose those and press |
|---|
| 2559 | OK. Cancel in either dialog will cancel the operation. The equivalenced |
|---|
| 2560 | parameters will show as an equation of the form M<sub>1</sub>*P<sub>1</sub>+M<sub>2</sub>*P<sub>2</sub>=0; |
|---|
| 2561 | usually M1=1.0 and M2=-1.0, but can be changed via the ‘Edit’ |
|---|
| 2562 | button. The keyword ‘EQUIV’ marks it as <span class=GramE>an |
|---|
| 2563 | equivalence</span>. A Delete button can be used to remove it.<o:p></o:p></span></p> |
|---|
| 2564 | |
|---|
| 2565 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2566 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
|---|
| 2567 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2568 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2569 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
|---|
| 2570 | constraint</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2571 | – select a list of parameters whose sum (with possible non-unitary |
|---|
| 2572 | multipliers) is fixed. For example, the sum of site fractions for atoms on the |
|---|
| 2573 | same site could be fixed to unity. If selected, a dialog box will appear with a |
|---|
| 2574 | list of the available parameters. Select one and press OK; a second dialog box |
|---|
| 2575 | will appear with only those parameters that can be used in a constraint with |
|---|
| 2576 | the first one. Choose those and press OK. Cancel in either dialog will cancel |
|---|
| 2577 | the operation. The equivalenced parameters will show as an equation of the form |
|---|
| 2578 | M<sub>1</sub>*P<sub>1</sub>+M<sub>2</sub>*P<sub>2</sub>+…=C; the |
|---|
| 2579 | multipliers M1, <span class=GramE>M2, …</span> and C can be changed via |
|---|
| 2580 | the ‘Edit’ button. The keyword ‘CONSTR’ marks it as a |
|---|
| 2581 | constraint. A Delete button can be used to remove it.<o:p></o:p></span></p> |
|---|
| 2582 | |
|---|
| 2583 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 2584 | text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
|---|
| 2585 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2586 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2587 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
|---|
| 2588 | function</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2589 | – this is very similar the “Add constraint” type except that |
|---|
| 2590 | the result of the sum can be varied in the refinement. The keyword |
|---|
| 2591 | ‘FUNCT’ marks it as a function; the ‘Refine?’ box |
|---|
| 2592 | indicates your choice to refine the result of the sum. A Delete button can be |
|---|
| 2593 | used to remove it.<o:p></o:p></span></p> |
|---|
| 2594 | |
|---|
| 2595 | <h4><a name=Restraints><span style='mso-fareast-font-family:"Times New Roman"'>Restraints</span></a><span |
|---|
| 2596 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 2597 | |
|---|
| 2598 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2599 | window is empty<o:p></o:p></span></p> |
|---|
| 2600 | |
|---|
| 2601 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2602 | |
|---|
| 2603 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Nothing |
|---|
| 2604 | just yet<o:p></o:p></span></p> |
|---|
| 2605 | |
|---|
| 2606 | <h4><a name=Sequential></a><u><span style='mso-fareast-font-family:"Times New Roman"'>Sequential</span></u><span |
|---|
| 2607 | style='mso-fareast-font-family:"Times New Roman"'> refinement results<o:p></o:p></span></h4> |
|---|
| 2608 | |
|---|
| 2609 | <p class=MsoNormal>In this window is tabulated the results of your sequential |
|---|
| 2610 | refinement. The columns are the parameter names; the naming convention is |
|---|
| 2611 | ‘p<span class=GramE>:h:name:n’</span> where p is the phase number, |
|---|
| 2612 | h is the histogram number, name is the parameter name, and num (if needed) is |
|---|
| 2613 | the item number (e.g. atom number). The rows are the data sets used in the |
|---|
| 2614 | sequential refinement.</p> |
|---|
| 2615 | |
|---|
| 2616 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2617 | |
|---|
| 2618 | <h5><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></h5> |
|---|
| 2619 | |
|---|
| 2620 | <h3>Histograms</h3> |
|---|
| 2621 | |
|---|
| 2622 | <p class=MsoNormal>These are shown in the data tree with a prefix of |
|---|
| 2623 | ‘PWDR’, ’HKLF’, ‘IMG’, ‘PDF’ or |
|---|
| 2624 | ‘XXXX’ (future – restraints??) and usually a file name. These |
|---|
| 2625 | constitute the data sets (‘Histograms’) to be used by GSAS-II for |
|---|
| 2626 | analysis. Selection of these items does not produce any information in the data |
|---|
| 2627 | window but does display the data in the Plots Window. They are described below.</p> |
|---|
| 2628 | |
|---|
| 2629 | <h3><a name="PWD_Analysis"></a>Powder Histograms - PWDR</h3> |
|---|
| 2630 | |
|---|
| 2631 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>When |
|---|
| 2632 | a powder diffraction data set (prefix ‘PWDR’) is selected from the </span><a |
|---|
| 2633 | href="#Data_tree"><span style='mso-fareast-font-family:"Times New Roman"'>data |
|---|
| 2634 | tree</span></a><span style='mso-fareast-font-family:"Times New Roman"'>, a |
|---|
| 2635 | variety of subcategories in the tree are shown. The items that are shown depend |
|---|
| 2636 | on the data set type. Selecting a subcategory raises the window listed below. <o:p></o:p></span></p> |
|---|
| 2637 | |
|---|
| 2638 | <h5><a name=Comments></a><a name=""></a><span style='mso-bookmark:Comments'><span |
|---|
| 2639 | style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
|---|
| 2640 | |
|---|
| 2641 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l20 level1 lfo4'><span |
|---|
| 2642 | style='mso-bookmark:Comments'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 2643 | "Times New Roman"'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 2644 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>Menu |
|---|
| 2645 | ‘<b style='mso-bidi-font-weight:normal'>Analysis</b>’ – <o:p></o:p></span></span></p> |
|---|
| 2646 | |
|---|
| 2647 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 2648 | text-indent:-.25in;mso-list:l18 level1 lfo5'><span style='mso-bookmark:Comments'><![if !supportLists]><span |
|---|
| 2649 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2650 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2651 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Analyze</span></b></span><span |
|---|
| 2652 | style='mso-bookmark:Comments'><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2653 | – this produces a ‘normal probability’ plot for the |
|---|
| 2654 | refinement result as bounded by the limits. The slope and intercept of the |
|---|
| 2655 | curve in the central region (-1 < </span></span><span style='mso-bookmark: |
|---|
| 2656 | Comments'><span style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>D</span></span><span |
|---|
| 2657 | style='mso-bookmark:Comments'><span style='mso-fareast-font-family:"Times New Roman"'>/</span></span><span |
|---|
| 2658 | style='mso-bookmark:Comments'><span style='font-family:Symbol;mso-fareast-font-family: |
|---|
| 2659 | "Times New Roman"'>s</span></span><span style='mso-bookmark:Comments'><span |
|---|
| 2660 | style='mso-fareast-font-family:"Times New Roman"'> < 1) are shown on the |
|---|
| 2661 | plot status line. The slope is the square root of GOF for the best fit set of |
|---|
| 2662 | data points (~68% of the data).<o:p></o:p></span></span></p> |
|---|
| 2663 | |
|---|
| 2664 | <h4><span style='mso-bookmark:Comments'><u>Comments<o:p></o:p></u></span></h4> |
|---|
| 2665 | |
|---|
| 2666 | <p class=MsoNormal><span style='mso-bookmark:Comments'>This window shows |
|---|
| 2667 | whatever comment lines (preceded by “#”) found when the powder data |
|---|
| 2668 | file was read by GSAS-II. If you are lucky, there will be useful information |
|---|
| 2669 | here (e.g. sample name, date collected, wavelength used, etc.). If not, this |
|---|
| 2670 | window will be blank. The text is read-only in that anything you try to enter |
|---|
| 2671 | here is not saved.</span></p> |
|---|
| 2672 | |
|---|
| 2673 | <span style='mso-bookmark:Comments'></span> |
|---|
| 2674 | |
|---|
| 2675 | <h4><a name=Limits><u><span style='mso-fareast-font-family:"Times New Roman"'>Limits</span></u></a><u><span |
|---|
| 2676 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></h4> |
|---|
| 2677 | |
|---|
| 2678 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2679 | window shows the limits in position to be used in any fitting for this powder |
|---|
| 2680 | pattern. The ‘original’ values are obtained from the minimum & |
|---|
| 2681 | maximum values in the powder pattern. You can modify ‘changed’ as |
|---|
| 2682 | needed.<o:p></o:p></span></p> |
|---|
| 2683 | |
|---|
| 2684 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2685 | |
|---|
| 2686 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
|---|
| 2687 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2688 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2689 | style='mso-fareast-font-family:"Times New Roman"'>You can change <span |
|---|
| 2690 | class=SpellE>Tmin</span> and <span class=SpellE>Tmax</span> in the |
|---|
| 2691 | ‘changed’ row as needed. Use the mouse to select the value to be |
|---|
| 2692 | changed (the background on the box will be blue or have a black border or a |
|---|
| 2693 | vertical bar will appear in the value), then enter the new value and press |
|---|
| 2694 | Enter or click the mouse elsewhere in the Background window. This will set the |
|---|
| 2695 | new value.<o:p></o:p></span></p> |
|---|
| 2696 | |
|---|
| 2697 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
|---|
| 2698 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2699 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2700 | style='mso-fareast-font-family:"Times New Roman"'>Modify the values of |
|---|
| 2701 | ‘changed’; this can be done on the plot by dragging the limit bars |
|---|
| 2702 | (left – vertical green dashed line, right – vertical red dashed |
|---|
| 2703 | line) into position. A left or right mouse click on a data point on the plot |
|---|
| 2704 | will set the associated limit. In either case the appropriate value on the |
|---|
| 2705 | ‘changed’ row will be updated immediately.<o:p></o:p></span></p> |
|---|
| 2706 | |
|---|
| 2707 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
|---|
| 2708 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2709 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2710 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 2711 | style='mso-bidi-font-weight:normal'>File</b>’ – <o:p></o:p></span></p> |
|---|
| 2712 | |
|---|
| 2713 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 2714 | text-indent:-.25in;mso-list:l3 level2 lfo6;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2715 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2716 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2717 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
|---|
| 2718 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
|---|
| 2719 | limits shown to other selected powder patterns. If used, a dialog box (Copy Parameters) |
|---|
| 2720 | will appear showing the list of available powder patterns, you can copy the |
|---|
| 2721 | limits parameters to any or all of them; select ‘All’ to copy them |
|---|
| 2722 | to all patterns. Then select ‘OK’ to do the copy; |
|---|
| 2723 | ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
|---|
| 2724 | |
|---|
| 2725 | <h4><a name=Background><u><span style='mso-fareast-font-family:"Times New Roman"'>Background<o:p></o:p></span></u></a></h4> |
|---|
| 2726 | |
|---|
| 2727 | <span style='mso-bookmark:Background'></span> |
|---|
| 2728 | |
|---|
| 2729 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2730 | window shows the choice of background functions and coefficients to be used in |
|---|
| 2731 | fitting this powder pattern. There are three types of contributions available |
|---|
| 2732 | for the background:<o:p></o:p></span></p> |
|---|
| 2733 | |
|---|
| 2734 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>1). |
|---|
| 2735 | A continuous empirical function (‘<span class=SpellE>chebyschev</span>’, |
|---|
| 2736 | ‘cosine’, ‘<span class=SpellE><span class=GramE>lin</span></span> |
|---|
| 2737 | interpolate’, ‘inv interpolate’ & ‘log |
|---|
| 2738 | interpolate’). The latter three select fixed points with spacing that is <span |
|---|
| 2739 | class=GramE>either equal</span>, inversely equal or equal on a log scale of the |
|---|
| 2740 | x-coordinate. The set of magnitudes at each point then comprise the background |
|---|
| 2741 | variables. All are refined when refine is selected.<o:p></o:p></span></p> |
|---|
| 2742 | |
|---|
| 2743 | <p class=MsoNormal style='tab-stops:0in'><span style='mso-fareast-font-family: |
|---|
| 2744 | "Times New Roman"'>2). A set of Debye diffuse scattering equation terms of the |
|---|
| 2745 | form:<o:p></o:p></span></p> |
|---|
| 2746 | |
|---|
| 2747 | <p class=MsoNormal style='tab-stops:0in'><span style='mso-fareast-font-family: |
|---|
| 2748 | "Times New Roman"'><span style='mso-tab-count:1'> </span></span><!--[if gte msEquation 12]><m:oMath><i |
|---|
| 2749 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 2750 | mso-fareast-font-family:"Times New Roman"'><span style='mso-tab-count:3'> </span><m:r>B</m:r><m:r>=</m:r><m:r>A</m:r></span></i><m:d><m:dPr><span |
|---|
| 2751 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 2752 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 2753 | normal'><m:ctrlPr></m:ctrlPr></span></m:dPr><m:e><m:f><m:fPr><m:type m:val="skw"/><span |
|---|
| 2754 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 2755 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 2756 | normal'><m:ctrlPr></m:ctrlPr></span></m:fPr><m:num><i style='mso-bidi-font-style: |
|---|
| 2757 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 2758 | "Times New Roman"'><m:r>sinQR</m:r></span></i></m:num><m:den><i |
|---|
| 2759 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 2760 | mso-fareast-font-family:"Times New Roman"'><m:r>QR</m:r></span></i></m:den></m:f></m:e></m:d><m:sSup><m:sSupPr><span |
|---|
| 2761 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 2762 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 2763 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 2764 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 2765 | "Times New Roman"'><m:r>e</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
|---|
| 2766 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 2767 | "Times New Roman"'><m:r>-</m:r><m:r>U</m:r></span></i><m:sSup><m:sSupPr><span |
|---|
| 2768 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 2769 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 2770 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 2771 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 2772 | "Times New Roman"'><m:r>Q</m:r></span></i></m:e><m:sup><i |
|---|
| 2773 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 2774 | mso-fareast-font-family:"Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup></m:sup></m:sSup></m:oMath><![endif]--><![if !msEquation]><span |
|---|
| 2775 | style='font-size:12.0pt;font-family:"Times New Roman","serif";mso-fareast-font-family: |
|---|
| 2776 | "Times New Roman";mso-fareast-theme-font:minor-fareast;position:relative; |
|---|
| 2777 | top:16.0pt;mso-text-raise:-16.0pt;mso-ansi-language:EN-US;mso-fareast-language: |
|---|
| 2778 | EN-US;mso-bidi-language:AR-SA'><!--[if gte vml 1]><v:shape id="_x0000_i1025" |
|---|
| 2779 | type="#_x0000_t75" style='width:133.5pt;height:38.25pt'> |
|---|
| 2780 | <v:imagedata src="gsasII_files/image001.png" o:title="" chromakey="white"/> |
|---|
| 2781 | </v:shape><![endif]--><![if !vml]><img width=178 height=51 |
|---|
| 2782 | src="gsasII_files/image002.gif" v:shapes="_x0000_i1025"><![endif]></span><![endif]><span |
|---|
| 2783 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-tab-count: |
|---|
| 2784 | 1'> </span><o:p></o:p></span></p> |
|---|
| 2785 | |
|---|
| 2786 | <p class=MsoNormal><span class=GramE><span style='mso-fareast-font-family:"Times New Roman"'>where</span></span><span |
|---|
| 2787 | style='mso-fareast-font-family:"Times New Roman"'> A,R & U are the possible |
|---|
| 2788 | variables and can be individually selected as desired; Q = 2</span><span |
|---|
| 2789 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>p</span><span |
|---|
| 2790 | style='mso-fareast-font-family:"Times New Roman"'>/d.<o:p></o:p></span></p> |
|---|
| 2791 | |
|---|
| 2792 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>3). A |
|---|
| 2793 | set of individual Bragg peaks using the pseudo-Voigt profile function as their |
|---|
| 2794 | shapes. Their parameters are ‘<span class=SpellE>pos</span>’, |
|---|
| 2795 | ’<span class=SpellE>int</span>’, ‘sig’ & |
|---|
| 2796 | ‘gam’; each can be selected for refinement. The default values for |
|---|
| 2797 | sig & gam (=0.10) are for very sharp peaks, you may adjust them accordingly |
|---|
| 2798 | to the kind of peak you are trying to fit before trying to refine them.<o:p></o:p></span></p> |
|---|
| 2799 | |
|---|
| 2800 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2801 | |
|---|
| 2802 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2803 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2804 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2805 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 2806 | style='mso-bidi-font-weight:normal'>File</b>’ – <o:p></o:p></span></p> |
|---|
| 2807 | |
|---|
| 2808 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2809 | auto;text-indent:-.25in;mso-list:l2 level1 lfo8'><![if !supportLists]><span |
|---|
| 2810 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2811 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2812 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
|---|
| 2813 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
|---|
| 2814 | background parameters shown to other selected powder patterns. If used, a |
|---|
| 2815 | dialog box (Copy Parameters) will appear showing the list of available powder |
|---|
| 2816 | patterns, you can copy the background parameters to any or all of them; select |
|---|
| 2817 | ‘All’ to copy them to all patterns. Then select ‘OK’ to |
|---|
| 2818 | do the copy; ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
|---|
| 2819 | |
|---|
| 2820 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2821 | auto;text-indent:-.25in;mso-list:l2 level1 lfo8'><![if !supportLists]><span |
|---|
| 2822 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2823 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2824 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
|---|
| 2825 | flags </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
|---|
| 2826 | <span class=GramE>this copies</span> only the refinement flags shown to other |
|---|
| 2827 | selected powder patterns. If used, a dialog box (Copy Refinement Flags) will |
|---|
| 2828 | appear showing the list of available powder patterns, you can copy the |
|---|
| 2829 | refinement flags to any or all of them; select ‘All’ to copy them |
|---|
| 2830 | to all patterns. Then select ‘OK’ to do the copy; |
|---|
| 2831 | ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
|---|
| 2832 | |
|---|
| 2833 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2834 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2835 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2836 | style='mso-fareast-font-family:"Times New Roman"'>You can select a different |
|---|
| 2837 | Background function from the pull down tab.<o:p></o:p></span></p> |
|---|
| 2838 | |
|---|
| 2839 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2840 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2841 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2842 | style='mso-fareast-font-family:"Times New Roman"'>You can choose to refine/not |
|---|
| 2843 | refine the background coefficients.<o:p></o:p></span></p> |
|---|
| 2844 | |
|---|
| 2845 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2846 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 2847 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2848 | style='mso-fareast-font-family:"Times New Roman"'>You can select the number of |
|---|
| 2849 | background coefficients to be used (1-36).<o:p></o:p></span></p> |
|---|
| 2850 | |
|---|
| 2851 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2852 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
|---|
| 2853 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2854 | style='mso-fareast-font-family:"Times New Roman"'>You can change individual |
|---|
| 2855 | background coefficient values. Enter the value then press Enter or click the |
|---|
| 2856 | mouse elsewhere in the Background window. This will set the new value.<o:p></o:p></span></p> |
|---|
| 2857 | |
|---|
| 2858 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2859 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>6.<span |
|---|
| 2860 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2861 | style='mso-fareast-font-family:"Times New Roman"'>You can introduce one or more |
|---|
| 2862 | Debye scattering terms into the background. For each one you should enter a |
|---|
| 2863 | sensible value for ‘R’ – an expected interatomic distance in |
|---|
| 2864 | an amorphous phase is appropriate. Select parameters to refine; usually start |
|---|
| 2865 | with the ‘A’ coefficients.<o:p></o:p></span></p> |
|---|
| 2866 | |
|---|
| 2867 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
|---|
| 2868 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>7.<span |
|---|
| 2869 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2870 | style='mso-fareast-font-family:"Times New Roman"'>You can introduce single |
|---|
| 2871 | Bragg peaks into the background. For each you should specify at least the |
|---|
| 2872 | position. Select parameters to refine; usually start with the ‘<span |
|---|
| 2873 | class=SpellE>int</span>’ coefficients.<o:p></o:p></span></p> |
|---|
| 2874 | |
|---|
| 2875 | <h4><a name="Instrument_Parameters"><u><span style='mso-fareast-font-family: |
|---|
| 2876 | "Times New Roman"'>Instrument Parameters</span></u></a><u><span |
|---|
| 2877 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></h4> |
|---|
| 2878 | |
|---|
| 2879 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 2880 | window shows the instrument parameters for the selected powder data set. <o:p></o:p></span></p> |
|---|
| 2881 | |
|---|
| 2882 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 2883 | |
|---|
| 2884 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
|---|
| 2885 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 2886 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2887 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 2888 | style='mso-bidi-font-weight:normal'>Operations</b>’ –<o:p></o:p></span></p> |
|---|
| 2889 | |
|---|
| 2890 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2891 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2892 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 2893 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2894 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Load |
|---|
| 2895 | profile… </span></b><span style='mso-fareast-font-family:"Times New Roman"'>- |
|---|
| 2896 | loads a GSAS-II instrument parameter file (<span class=SpellE>name.instprm</span>), |
|---|
| 2897 | replacing the existing instrument parameter values. All refinement flags are |
|---|
| 2898 | unset.<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
|---|
| 2899 | |
|---|
| 2900 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2901 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2902 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 2903 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2904 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Save |
|---|
| 2905 | profile… - </span></b><span style='mso-fareast-font-family:"Times New Roman"'>saves |
|---|
| 2906 | the current instrument parameter values in a simple text file (<span |
|---|
| 2907 | class=SpellE>name.instprm</span>); you will be prompted for the file name |
|---|
| 2908 | – do not change the extension. This file may be edited but heed the |
|---|
| 2909 | warning to not change the parameter names, the order of the parameter records |
|---|
| 2910 | or add new parameter records as this will invalidate the file. You may only |
|---|
| 2911 | change the numeric values if necessary. You can change or add comment records |
|---|
| 2912 | (begins with ‘#’).<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
|---|
| 2913 | |
|---|
| 2914 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2915 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2916 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 2917 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2918 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Reset |
|---|
| 2919 | profile </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
|---|
| 2920 | resets the values for the instrument parameters to the default values shown in |
|---|
| 2921 | parentheses for each entry.<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
|---|
| 2922 | |
|---|
| 2923 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2924 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2925 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 2926 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2927 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
|---|
| 2928 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
|---|
| 2929 | instrument parameters shown to other selected powder patterns. If used, a |
|---|
| 2930 | dialog box (Copy parameters) will appear showing the list of available powder |
|---|
| 2931 | patterns, you can copy the instrument parameters to any or all of them; select ‘All’ |
|---|
| 2932 | to copy them to all patterns. Then select ‘OK’ to do the copy; |
|---|
| 2933 | ‘Cancel’ to cancel the operation. The copy will only work for |
|---|
| 2934 | instrument parameters that are commensurate with the one that is shown, e.g. |
|---|
| 2935 | single radiation patterns will not be updated from K</span><sub><span |
|---|
| 2936 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2937 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
|---|
| 2938 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
|---|
| 2939 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2940 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
|---|
| 2941 | style='mso-fareast-font-family:"Times New Roman"'> ones.<o:p></o:p></span></p> |
|---|
| 2942 | |
|---|
| 2943 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2944 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2945 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 2946 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2947 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
|---|
| 2948 | flags </span></b><span style='mso-fareast-font-family:"Times New Roman"'>- |
|---|
| 2949 | – this copies the instrument parameter refinement flags shown to other |
|---|
| 2950 | selected powder patterns. If used, a dialog box (Copy refinement flags) will |
|---|
| 2951 | appear showing the list of available powder patterns, you can copy the instrument |
|---|
| 2952 | parameter refinement flags to any or all of them; select ‘All’ to |
|---|
| 2953 | copy them to all patterns. Then select ‘OK’ to do the copy; |
|---|
| 2954 | ‘Cancel’ to cancel the operation. The copy will only work for |
|---|
| 2955 | instrument parameters that are commensurate with the one that is shown, e.g. |
|---|
| 2956 | single radiation patterns will not be updated from K</span><sub><span |
|---|
| 2957 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2958 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
|---|
| 2959 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
|---|
| 2960 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2961 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
|---|
| 2962 | style='mso-fareast-font-family:"Times New Roman"'> ones.<o:p></o:p></span></p> |
|---|
| 2963 | |
|---|
| 2964 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 2965 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 2966 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
|---|
| 2967 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 2968 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Change |
|---|
| 2969 | radiation</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 2970 | – this changes the radiation between single wavelength (e.g. for |
|---|
| 2971 | synchrotron source) and K</span><sub><span style='font-family:Symbol; |
|---|
| 2972 | mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2973 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
|---|
| 2974 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
|---|
| 2975 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
|---|
| 2976 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
|---|
| 2977 | style='mso-fareast-font-family:"Times New Roman"'> wavelength pairs (e.g. a |
|---|
| 2978 | laboratory tube source).<o:p></o:p></span></p> |
|---|
| 2979 | |
|---|
| 2980 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
|---|
| 2981 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 2982 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2983 | style='mso-fareast-font-family:"Times New Roman"'>You can change any of the |
|---|
| 2984 | profile coefficients<o:p></o:p></span></p> |
|---|
| 2985 | |
|---|
| 2986 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
|---|
| 2987 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 2988 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 2989 | style='mso-fareast-font-family:"Times New Roman"'>You can choose to refine any |
|---|
| 2990 | profile coefficients. <b style='mso-bidi-font-weight:normal'>NB</b>: In certain |
|---|
| 2991 | circumstances some choices are ignored e.g. Zero is not refined during peak |
|---|
| 2992 | fitting. Also some choices may lead to unstable refinement, e.g. <span |
|---|
| 2993 | class=GramE>Lam</span> refinement and lattice parameter refinement. Examine the |
|---|
| 2994 | ‘</span><a href="#Covariance"><span style='mso-fareast-font-family:"Times New Roman"'>Covariance’</span></a><span |
|---|
| 2995 | style='mso-fareast-font-family:"Times New Roman"'> display for highly |
|---|
| 2996 | correlated parameters.<o:p></o:p></span></p> |
|---|
| 2997 | |
|---|
| 2998 | <h4><a name="Sample_Parameters"></a><u><span style='mso-fareast-font-family: |
|---|
| 2999 | "Times New Roman"'>Sample Parameters<o:p></o:p></span></u></h4> |
|---|
| 3000 | |
|---|
| 3001 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3002 | window show the various sample dependent parameters for this powder pattern. The |
|---|
| 3003 | presence of a refine button indicates which can be refined while others are |
|---|
| 3004 | fixed. All values can be changed in this window.<o:p></o:p></span></p> |
|---|
| 3005 | |
|---|
| 3006 | <h5><a name="Powder_Peaks"></a><a name="Peak_List"><span style='mso-bookmark: |
|---|
| 3007 | Powder_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'>What can |
|---|
| 3008 | I do here?</span></span></a><span style='mso-bookmark:Peak_List'><span |
|---|
| 3009 | style='mso-bookmark:Powder_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3010 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'><o:p></o:p></span></span></span></h5> |
|---|
| 3011 | |
|---|
| 3012 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l6 level1 lfo11'><span |
|---|
| 3013 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><![if !supportLists]><span |
|---|
| 3014 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3015 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>1.<span |
|---|
| 3016 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3017 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3018 | normal;mso-bidi-font-weight:bold'>Menu ‘</span></span></span><span |
|---|
| 3019 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><span |
|---|
| 3020 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>File’</span></span></span><span |
|---|
| 3021 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><span |
|---|
| 3022 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3023 | normal;mso-bidi-font-weight:bold'> – <o:p></o:p></span></span></span></h5> |
|---|
| 3024 | |
|---|
| 3025 | <p class=MsoListParagraphCxSpFirst style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 3026 | text-indent:-.25in;mso-list:l6 level2 lfo11;tab-stops:list 1.0in'><span |
|---|
| 3027 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><![if !supportLists]><span |
|---|
| 3028 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3029 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3030 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b></span></span><span |
|---|
| 3031 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><span |
|---|
| 3032 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
|---|
| 3033 | sample parameters shown to other selected powder patterns. If used, a dialog |
|---|
| 3034 | box (Copy parameters) will appear showing the list of available powder |
|---|
| 3035 | patterns, you can copy the sample parameters to any or all of them; select |
|---|
| 3036 | ‘All’ to copy them to all patterns. Then select ‘OK’ to |
|---|
| 3037 | do the copy; ‘Cancel’ to cancel the operation. <o:p></o:p></span></span></span></p> |
|---|
| 3038 | |
|---|
| 3039 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 3040 | text-indent:-.25in;mso-list:l6 level2 lfo11;tab-stops:list 1.0in'><span |
|---|
| 3041 | style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><![if !supportLists]><span |
|---|
| 3042 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3043 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3044 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
|---|
| 3045 | flags</span></b></span></span><span style='mso-bookmark:Peak_List'><span |
|---|
| 3046 | style='mso-bookmark:Powder_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3047 | - – this copies the sample parameter refinement flags shown to other |
|---|
| 3048 | selected powder patterns. If used, a dialog box (Copy refinement flags) will |
|---|
| 3049 | appear showing the list of available powder patterns, you can copy the sample |
|---|
| 3050 | parameter refinement flags to any or all of them; select ‘All’ to |
|---|
| 3051 | copy them to all patterns. Then select ‘OK’ to do the copy; |
|---|
| 3052 | ‘Cancel’ to cancel the operation. <o:p></o:p></span></span></span></p> |
|---|
| 3053 | |
|---|
| 3054 | <h4><span style='mso-bookmark:Peak_List'><span style='mso-bookmark:Powder_Peaks'><span |
|---|
| 3055 | style='mso-fareast-font-family:"Times New Roman"'>Peak List</span></span></span><span |
|---|
| 3056 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 3057 | |
|---|
| 3058 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3059 | window shows the list of peaks that will be used by the peak fitting |
|---|
| 3060 | refinement. It is filled by picking peaks in the powder pattern displayed in |
|---|
| 3061 | the GSASII Plots window as a sequence of ‘+’ marks.<o:p></o:p></span></p> |
|---|
| 3062 | |
|---|
| 3063 | <h5><a name="Index_Peaks"></a><a name="Index_Peak_List"></a><span |
|---|
| 3064 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'>What |
|---|
| 3065 | can I do here? </span></span><span style='mso-bookmark:Index_Peaks'><span |
|---|
| 3066 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3067 | normal;mso-bidi-font-weight:bold'><o:p></o:p></span></span></h5> |
|---|
| 3068 | |
|---|
| 3069 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3070 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3071 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
|---|
| 3072 | bold'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3073 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3074 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>Menu ‘</span></span><span |
|---|
| 3075 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3076 | color:windowtext'>Peak Fitting</span></span><span style='mso-bookmark:Index_Peaks'><span |
|---|
| 3077 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3078 | normal;mso-bidi-font-weight:bold'>’ – <o:p></o:p></span></span></h5> |
|---|
| 3079 | |
|---|
| 3080 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
|---|
| 3081 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
|---|
| 3082 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3083 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>a.<span |
|---|
| 3084 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3085 | class=SpellE><span style='mso-fareast-font-family:"Times New Roman";color:windowtext'>UnDo</span></span></span><span |
|---|
| 3086 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3087 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'> – resets |
|---|
| 3088 | peak parameters, background and instrument parameter values varied in the last |
|---|
| 3089 | peak fitting refinement back to their original values. Use this to recover from |
|---|
| 3090 | a failed refinement. Note:<span style='mso-spacerun:yes'> </span>there is |
|---|
| 3091 | only a single level of recovery available.<o:p></o:p></span></span></h5> |
|---|
| 3092 | |
|---|
| 3093 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
|---|
| 3094 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
|---|
| 3095 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3096 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>b.<span |
|---|
| 3097 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3098 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>LSQ <span |
|---|
| 3099 | class=SpellE>PeakFit</span></span></span><span style='mso-bookmark:Index_Peaks'><span |
|---|
| 3100 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3101 | normal;mso-bidi-font-weight:bold'> – perform a least squares fit of the |
|---|
| 3102 | peaks in <span class=SpellE>PeakList</span> to the data. Any peak parameters, |
|---|
| 3103 | background parameters and instrument parameters with refine checked will be |
|---|
| 3104 | varied in this refinement. The refinement will proceed until convergence. We |
|---|
| 3105 | suggest you vary the intensity along with the background first (the default), |
|---|
| 3106 | then vary the position and instrument parameters after. The order will depend |
|---|
| 3107 | on how poor is the initial estimate of the instrument parameters (U, V, W, X, Y |
|---|
| 3108 | & SH/L). To determine how to proceed, examine in detail the powder pattern |
|---|
| 3109 | difference curve displayed in the GSASII Plots window. If individual peaks show |
|---|
| 3110 | peak widths that are widely different, their individual sigma and gamma |
|---|
| 3111 | parameters may be refined. If the refinement results in negative peak |
|---|
| 3112 | coefficients, these will be highlighted in red. If this happens, you should </span></span><span |
|---|
| 3113 | style='mso-bookmark:Index_Peaks'><span class=SpellE><span style='mso-fareast-font-family: |
|---|
| 3114 | "Times New Roman";color:windowtext'>UnDo</span></span></span><span |
|---|
| 3115 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3116 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'> the refinement |
|---|
| 3117 | and reconsider your choice of parameters to be varied.<o:p></o:p></span></span></h5> |
|---|
| 3118 | |
|---|
| 3119 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
|---|
| 3120 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
|---|
| 3121 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3122 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>c.<span |
|---|
| 3123 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3124 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>LSQ one |
|---|
| 3125 | cycle </span></span><span style='mso-bookmark:Index_Peaks'><span |
|---|
| 3126 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3127 | normal;mso-bidi-font-weight:bold'>– perform a single cycle of least |
|---|
| 3128 | squares refinement. This can be used in difficult cases to get a refinement |
|---|
| 3129 | started toward convergence.<o:p></o:p></span></span></h5> |
|---|
| 3130 | |
|---|
| 3131 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
|---|
| 3132 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
|---|
| 3133 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3134 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>d.<span |
|---|
| 3135 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3136 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>Reset sig |
|---|
| 3137 | and gam </span></span><span style='mso-bookmark:Index_Peaks'><span |
|---|
| 3138 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3139 | normal;mso-bidi-font-weight:bold'>– this resets the values of sigma and |
|---|
| 3140 | gamma to those computed from the instrument parameters U, V, W, <span |
|---|
| 3141 | class=GramE>X</span> & Y.<o:p></o:p></span></span></h5> |
|---|
| 3142 | |
|---|
| 3143 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
|---|
| 3144 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
|---|
| 3145 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
|---|
| 3146 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>e.<span |
|---|
| 3147 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3148 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>Clear peaks </span></span><span |
|---|
| 3149 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3150 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>– this |
|---|
| 3151 | removes all the peaks from the Peak List.<o:p></o:p></span></span></h5> |
|---|
| 3152 | |
|---|
| 3153 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3154 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3155 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
|---|
| 3156 | bold'><span style='mso-list:Ignore'>2.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3157 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3158 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can add |
|---|
| 3159 | peaks to the Peak list using the mouse on the plot by: 1) position the pointer |
|---|
| 3160 | near to the top point on a peak, 2) press the left mouse button. The selected |
|---|
| 3161 | peak will be added to the Peak List in its correct sorted order and a blue |
|---|
| 3162 | vertical line will be plotted on that position. Be sure that the Zoom/Pan |
|---|
| 3163 | buttons are not selected on the Plot window. We recommend that you begin |
|---|
| 3164 | picking peaks from the right side of the pattern; that way the tool tip |
|---|
| 3165 | won’t be in your way as you select peaks.<o:p></o:p></span></span></h5> |
|---|
| 3166 | |
|---|
| 3167 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3168 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3169 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
|---|
| 3170 | bold'><span style='mso-list:Ignore'>3.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3171 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3172 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can move a |
|---|
| 3173 | Peak List item using the mouse on the plot by: 1) position the pointer on the |
|---|
| 3174 | blue line for the peak you wish to move, 2) holding the left mouse button down, |
|---|
| 3175 | drag to the desired position & then release the button. The peak line will |
|---|
| 3176 | be drawn in the new position. Be sure that the Zoom/Pan buttons are not |
|---|
| 3177 | selected on the Plot window.<o:p></o:p></span></span></h5> |
|---|
| 3178 | |
|---|
| 3179 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3180 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3181 | "Times New Roman"'><span style='mso-list:Ignore'>4.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3182 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
|---|
| 3183 | can change individual peak coefficient values. Enter the value then press Enter |
|---|
| 3184 | or Tab or click the mouse elsewhere in the Peak List window. This will set the |
|---|
| 3185 | new value.<o:p></o:p></span></span></p> |
|---|
| 3186 | |
|---|
| 3187 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3188 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3189 | "Times New Roman"'><span style='mso-list:Ignore'>5.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3190 | </span></span></span><![endif]>You can change the refine flags either by |
|---|
| 3191 | clicking on the box or by selecting one and then selecting the column (a single |
|---|
| 3192 | click on the column heading; column should show in blue). Then type |
|---|
| 3193 | ‘y’ to set the refine flags or ‘n’ to clear the flags. </span><span |
|---|
| 3194 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></p> |
|---|
| 3195 | |
|---|
| 3196 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
|---|
| 3197 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
|---|
| 3198 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
|---|
| 3199 | bold'><span style='mso-list:Ignore'>6.<span style='font:7.0pt "Times New Roman"'> |
|---|
| 3200 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3201 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can delete |
|---|
| 3202 | peaks in the Peak List by selecting rows (should appear in blue) and then pressing |
|---|
| 3203 | the Delete key. You can also delete peaks using the mouse on the plot by |
|---|
| 3204 | positioning the pointer on the blue line for the peak to be deleted and then |
|---|
| 3205 | pressing the right mouse button. The blue line should vanish and the |
|---|
| 3206 | corresponding peak will be removed from the Peak List. Be sure that the |
|---|
| 3207 | Zoom/Pan buttons are not selected on the Plot window.<o:p></o:p></span></span></h5> |
|---|
| 3208 | |
|---|
| 3209 | <h4><span style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family: |
|---|
| 3210 | "Times New Roman"'>Index Peak List</span></span><span style='mso-fareast-font-family: |
|---|
| 3211 | "Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 3212 | |
|---|
| 3213 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3214 | window shows the list of peaks that will be used for indexing (see </span><a |
|---|
| 3215 | href="#Unit_Cells_List"><span style='mso-fareast-font-family:"Times New Roman"'>Unit |
|---|
| 3216 | Cells List</span></a><span style='mso-fareast-font-family:"Times New Roman"'>). |
|---|
| 3217 | It must be filled before indexing can proceed. When indexing is completed, this |
|---|
| 3218 | display will show the resulting <span class=SpellE>hkl</span> values for every |
|---|
| 3219 | indexed reflection along with the calculated d-spacing (‘d-<span |
|---|
| 3220 | class=SpellE>calc</span>’) for the selected unit cell in </span><a |
|---|
| 3221 | href="#Unit_Cells_List"><span style='mso-fareast-font-family:"Times New Roman"'>Unit |
|---|
| 3222 | Cells List</span></a><span style='mso-fareast-font-family:"Times New Roman"'>.<o:p></o:p></span></p> |
|---|
| 3223 | |
|---|
| 3224 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3225 | |
|---|
| 3226 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l21 level1 lfo13'><![if !supportLists]><span |
|---|
| 3227 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3228 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3229 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 3230 | style='mso-bidi-font-weight:normal'>Operations</b>’ – <b |
|---|
| 3231 | style='mso-bidi-font-weight:normal'>Load/Reload</b> – loads the peak |
|---|
| 3232 | positions & intensities from the </span><a href="#Peak_List"><span |
|---|
| 3233 | style='mso-fareast-font-family:"Times New Roman"'>Peak List</span></a><span |
|---|
| 3234 | style='mso-fareast-font-family:"Times New Roman"'> to make them available for |
|---|
| 3235 | the indexing routine. The d-<span class=SpellE>obs</span> is obtained from |
|---|
| 3236 | Bragg’s Law after applying the Zero correction shown on the </span><a |
|---|
| 3237 | href="#Instrument_Parameters"><span style='mso-fareast-font-family:"Times New Roman"'>Instrument |
|---|
| 3238 | Parameters</span></a><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3239 | table to the position shown here.<o:p></o:p></span></p> |
|---|
| 3240 | |
|---|
| 3241 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l21 level1 lfo13'><![if !supportLists]><span |
|---|
| 3242 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3243 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3244 | style='mso-fareast-font-family:"Times New Roman"'>You may deselect individual |
|---|
| 3245 | peaks from indexing by unchecking the corresponding ‘use’ box.<o:p></o:p></span></p> |
|---|
| 3246 | |
|---|
| 3247 | <h4><a name="Cell_Indexing_Refine"></a><a name="Unit_Cells_List"></a><span |
|---|
| 3248 | style='mso-bookmark:Cell_Indexing_Refine'><span style='mso-fareast-font-family: |
|---|
| 3249 | "Times New Roman"'>Unit Cells List</span></span><span style='mso-fareast-font-family: |
|---|
| 3250 | "Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 3251 | |
|---|
| 3252 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3253 | window... <o:p></o:p></span></p> |
|---|
| 3254 | |
|---|
| 3255 | <h4><a name="Reflection_List"><span style='mso-fareast-font-family:"Times New Roman"'>Reflection |
|---|
| 3256 | List</span></a><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
|---|
| 3257 | |
|---|
| 3258 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3259 | window... <o:p></o:p></span></p> |
|---|
| 3260 | |
|---|
| 3261 | <h3>Single Crystal Histograms - HKLF</h3> |
|---|
| 3262 | |
|---|
| 3263 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>Pair Distribution |
|---|
| 3264 | Functions - PDF<o:p></o:p></span></h3> |
|---|
| 3265 | |
|---|
| 3266 | <h4><a name="PDF_Controls"></a><span style='mso-fareast-font-family:"Times New Roman"'>PDF |
|---|
| 3267 | Controls<o:p></o:p></span></h4> |
|---|
| 3268 | |
|---|
| 3269 | <p class=MsoNormal>This window </p> |
|---|
| 3270 | |
|---|
| 3271 | <h4><a name="I_Q"></a><span class=GramE><span style='mso-fareast-font-family: |
|---|
| 3272 | "Times New Roman"'>I(</span></span><span style='mso-fareast-font-family:"Times New Roman"'>Q), |
|---|
| 3273 | <a name="S_Q"></a>S(Q), <a name="F_Q"></a>F(Q) & <a name="G_R"></a>G(R)<o:p></o:p></span></h4> |
|---|
| 3274 | |
|---|
| 3275 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3276 | window... <o:p></o:p></span></p> |
|---|
| 3277 | |
|---|
| 3278 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>2-D Images – |
|---|
| 3279 | IMG<o:p></o:p></span></h3> |
|---|
| 3280 | |
|---|
| 3281 | <h4>Image Controls<a name="Image_Controls"></a></h4> |
|---|
| 3282 | |
|---|
| 3283 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3284 | window... <o:p></o:p></span></p> |
|---|
| 3285 | |
|---|
| 3286 | <h4><a name="_Image_Masks"></a><a href="#_Image_Masks"><span style='color:#4F81BD; |
|---|
| 3287 | mso-themecolor:accent1;text-decoration:none;text-underline:none'>Image Ma<span |
|---|
| 3288 | style='mso-bookmark:Image_Masks'></span>sks</span></a><![if !supportNestedAnchors]><a |
|---|
| 3289 | name="Image_Masks"></a><![endif]></h4> |
|---|
| 3290 | |
|---|
| 3291 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3292 | window... <o:p></o:p></span></p> |
|---|
| 3293 | |
|---|
| 3294 | <h3>Phase Windows</h3> |
|---|
| 3295 | |
|---|
| 3296 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>When |
|---|
| 3297 | a phase is selected from the <a href="#Data_tree">data tree</a>, parameters are |
|---|
| 3298 | shown for that selected phase in a tabbed window. Clicking on each tab raises |
|---|
| 3299 | the windows listed below. Each tab is identified by the underlined phrase in |
|---|
| 3300 | the following:<o:p></o:p></span></p> |
|---|
| 3301 | |
|---|
| 3302 | <h4><a name=General></a><a name="_Ref317241833"><span style='mso-bookmark:General'><u>General</u> |
|---|
| 3303 | Phase Parameters</span></a><span style='mso-bookmark:General'></span></h4> |
|---|
| 3304 | |
|---|
| 3305 | <span style='mso-bookmark:General'></span> |
|---|
| 3306 | |
|---|
| 3307 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3308 | gives overall parameters describing the phase such as the name, space group, |
|---|
| 3309 | the unit cell parameters and overall parameters for the atom present in the |
|---|
| 3310 | phase. It also has the controls for computing Fourier maps for this phase.<o:p></o:p></span></p> |
|---|
| 3311 | |
|---|
| 3312 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3313 | |
|---|
| 3314 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
|---|
| 3315 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3316 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3317 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
|---|
| 3318 | style='mso-bidi-font-weight:normal'>Compute’</b> – The compute menu |
|---|
| 3319 | shows computations that are possible for this phase.<o:p></o:p></span></p> |
|---|
| 3320 | |
|---|
| 3321 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3322 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3323 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3324 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3325 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Fourier |
|---|
| 3326 | maps</span></b><span style='mso-fareast-font-family:"Times New Roman"'> – |
|---|
| 3327 | compute Fourier maps according to the controls set at bottom of General page.<o:p></o:p></span></p> |
|---|
| 3328 | |
|---|
| 3329 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3330 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3331 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3332 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3333 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Search |
|---|
| 3334 | maps </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
|---|
| 3335 | search the computed Fourier map. Peaks that are above ‘Peak cutoff’ |
|---|
| 3336 | % of the maximum will be found in this procedure; they will be printed on the |
|---|
| 3337 | console and will be shown in the ‘<a href="gsasII.html">Map peaks</a>’ |
|---|
| 3338 | page. This page will immediately be shown and the peaks will be shown on the |
|---|
| 3339 | structure drawing for this phase as white 3-D crosses.<o:p></o:p></span></p> |
|---|
| 3340 | |
|---|
| 3341 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
|---|
| 3342 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3343 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3344 | style='mso-fareast-font-family:"Times New Roman"'>The items in the upper part |
|---|
| 3345 | of the General page that can be changed are Phase name, Phase type, Space |
|---|
| 3346 | group, unit cell parameters & refine flag. These are described in turn:<u><o:p></o:p></u></span></p> |
|---|
| 3347 | |
|---|
| 3348 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3349 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3350 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3351 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3352 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Phase |
|---|
| 3353 | name</span></b><span style='mso-fareast-font-family:"Times New Roman"'> – |
|---|
| 3354 | this is the name assigned to this phase. It should only be changed when the |
|---|
| 3355 | phase is initialized or imported.<u><o:p></o:p></u></span></p> |
|---|
| 3356 | |
|---|
| 3357 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3358 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3359 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3360 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3361 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Phase |
|---|
| 3362 | type – </span></b><span style='mso-fareast-font-family:"Times New Roman"'>this |
|---|
| 3363 | can only be set when there are no atoms in the Atoms page for this phase. |
|---|
| 3364 | Select it when the phase is initialized.<u><o:p></o:p></u></span></p> |
|---|
| 3365 | |
|---|
| 3366 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3367 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3368 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 3369 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3370 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Space |
|---|
| 3371 | group</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3372 | – this should be set when the phase is initialized; it can be changed |
|---|
| 3373 | later. Be careful about the impact on Atom site symmetry and multiplicity if |
|---|
| 3374 | you do. GSAS-II will recognize any legal space group symbol using the short |
|---|
| 3375 | Hermann-<span class=SpellE>Mauguin</span> forms; put a space between the axial |
|---|
| 3376 | fields (e.g. ‘F d 3 m’ not ‘Fd3m’). For space groups |
|---|
| 3377 | with a choice of origin (e.g. F d 3 m), GSAS-II always uses the 2<sup>nd</sup> |
|---|
| 3378 | setting where the center of inversion is located at the origin. The choice of |
|---|
| 3379 | space group will set the available unit cell parameters.<u><o:p></o:p></u></span></p> |
|---|
| 3380 | |
|---|
| 3381 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3382 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3383 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 3384 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3385 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Refine |
|---|
| 3386 | unit cell</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3387 | – set this flag to refine the unit cell parameters in a Rietveld or |
|---|
| 3388 | Pawley refinement. The actual parameters refined are the symmetry allowed terms |
|---|
| 3389 | (A<sub>0</sub>-A<sub>5</sub>) in the expression</span><i style='mso-bidi-font-style: |
|---|
| 3390 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3391 | "Times New Roman"'><br> |
|---|
| 3392 | </span></i><!--[if gte msEquation 12]><m:oMathPara><m:oMath><m:sSup><m:sSupPr><span |
|---|
| 3393 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3394 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3395 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3396 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3397 | "Times New Roman"'><m:r>d</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
|---|
| 3398 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3399 | "Times New Roman"'><m:r>*2</m:r></span></i></m:sup></m:sSup><i |
|---|
| 3400 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3401 | mso-fareast-font-family:"Times New Roman"'><m:r>=</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3402 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3403 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3404 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3405 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3406 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3407 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3408 | "Times New Roman"'><m:r>0</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
|---|
| 3409 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3410 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3411 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3412 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3413 | "Times New Roman"'><m:r>h</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
|---|
| 3414 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3415 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
|---|
| 3416 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3417 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3418 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3419 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3420 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3421 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3422 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3423 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3424 | "Times New Roman"'><m:r>1</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
|---|
| 3425 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3426 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3427 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3428 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3429 | "Times New Roman"'><m:r>k</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
|---|
| 3430 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3431 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
|---|
| 3432 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3433 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3434 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3435 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3436 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3437 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3438 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3439 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3440 | "Times New Roman"'><m:r>2</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
|---|
| 3441 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3442 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3443 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3444 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3445 | "Times New Roman"'><m:r>l</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
|---|
| 3446 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3447 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
|---|
| 3448 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3449 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3450 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3451 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3452 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3453 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3454 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3455 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3456 | "Times New Roman"'><m:r>3</m:r></span></i></m:sub></m:sSub><i |
|---|
| 3457 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3458 | mso-fareast-font-family:"Times New Roman"'><m:r>h</m:r><m:r>k</m:r><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3459 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3460 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3461 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3462 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3463 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3464 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3465 | "Times New Roman"'><m:r>4</m:r></span></i></m:sub></m:sSub><i |
|---|
| 3466 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3467 | mso-fareast-font-family:"Times New Roman"'><m:r>h</m:r><m:r>l</m:r><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
|---|
| 3468 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
|---|
| 3469 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
|---|
| 3470 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
|---|
| 3471 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3472 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
|---|
| 3473 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
|---|
| 3474 | "Times New Roman"'><m:r>5</m:r></span></i></m:sub></m:sSub><i |
|---|
| 3475 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3476 | mso-fareast-font-family:"Times New Roman"'><m:r>kl</m:r></span></i></m:oMath></m:oMathPara><![endif]--><![if !msEquation]><span |
|---|
| 3477 | style='font-size:12.0pt;font-family:"Times New Roman","serif";mso-fareast-font-family: |
|---|
| 3478 | "Times New Roman";mso-fareast-theme-font:minor-fareast;mso-ansi-language:EN-US; |
|---|
| 3479 | mso-fareast-language:EN-US;mso-bidi-language:AR-SA'><!--[if gte vml 1]><v:shape |
|---|
| 3480 | id="_x0000_i1025" type="#_x0000_t75" style='width:251.25pt;height:14.25pt'> |
|---|
| 3481 | <v:imagedata src="gsasII_files/image003.png" o:title="" chromakey="white"/> |
|---|
| 3482 | </v:shape><![endif]--><![if !vml]><img width=335 height=19 |
|---|
| 3483 | src="gsasII_files/image004.gif" v:shapes="_x0000_i1025"><![endif]></span><![endif]><u><span |
|---|
| 3484 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></p> |
|---|
| 3485 | |
|---|
| 3486 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3487 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
|---|
| 3488 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 3489 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3490 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 3491 | "Times New Roman"'>a</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 3492 | style='mso-fareast-font-family:"Times New Roman"'>, b, c, alpha, beta, gamma</span></b><span |
|---|
| 3493 | style='mso-fareast-font-family:"Times New Roman"'> – lattice parameters; |
|---|
| 3494 | only those permitted by the space group are shown. The volume is computed from |
|---|
| 3495 | the values entered.<u><o:p></o:p></u></span></p> |
|---|
| 3496 | |
|---|
| 3497 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
|---|
| 3498 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 3499 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3500 | style='mso-fareast-font-family:"Times New Roman"'>If there are entries in the |
|---|
| 3501 | Atoms page then the Elements table is shown next on the General page; you may |
|---|
| 3502 | select the isotope (only relevant for neutron diffraction experiments). The |
|---|
| 3503 | density is computed depending on this choice, the unit cell volume and the atom |
|---|
| 3504 | fractions/site multiplicities in the entries on the Atoms page.<u><o:p></o:p></u></span></p> |
|---|
| 3505 | |
|---|
| 3506 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
|---|
| 3507 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 3508 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3509 | style='mso-fareast-font-family:"Times New Roman"'>Fourier map controls are |
|---|
| 3510 | shown at the bottom of the General page. A completed Rietveld or Pawley |
|---|
| 3511 | refinement is required before a Fourier map can be computed. Select the desired |
|---|
| 3512 | type of map, the source of the reflection set and the map resolution desired.<u><o:p></o:p></u></span></p> |
|---|
| 3513 | |
|---|
| 3514 | <h4><a name=Data></a><u><span style='mso-fareast-font-family:"Times New Roman"'>Data |
|---|
| 3515 | </span></u><span style='mso-fareast-font-family:"Times New Roman"'>sets<u><o:p></o:p></u></span></h4> |
|---|
| 3516 | |
|---|
| 3517 | <p class=MsoNormal><o:p> </o:p></p> |
|---|
| 3518 | |
|---|
| 3519 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?</span><i |
|---|
| 3520 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
|---|
| 3521 | mso-fareast-font-family:"Times New Roman"'><br style='mso-special-character: |
|---|
| 3522 | line-break'> |
|---|
| 3523 | <![if !supportLineBreakNewLine]><br style='mso-special-character:line-break'> |
|---|
| 3524 | <![endif]></span></i><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h5> |
|---|
| 3525 | |
|---|
| 3526 | <h5><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></h5> |
|---|
| 3527 | |
|---|
| 3528 | <h4><a name=Atoms></a><u>Atom</u> Parameter<u>s</u></h4> |
|---|
| 3529 | |
|---|
| 3530 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3531 | |
|---|
| 3532 | <h4><a name=Texture></a><u>Texture</u> Parameters</h4> |
|---|
| 3533 | |
|---|
| 3534 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3535 | |
|---|
| 3536 | <h4><a name="Draw_Options"></a><u>Draw Options</u></h4> |
|---|
| 3537 | |
|---|
| 3538 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3539 | |
|---|
| 3540 | <h4><a name="Draw_Atoms"></a><u>Draw Atoms<o:p></o:p></u></h4> |
|---|
| 3541 | |
|---|
| 3542 | <p class=MsoNormal>This gives a list of the atoms and bonds that are to be |
|---|
| 3543 | rendered as lines, van der Waals radii balls, sticks, balls & sticks, |
|---|
| 3544 | ellipsoids & sticks or <span class=SpellE>polyhedra</span>. There are two |
|---|
| 3545 | menus for this tab; Edit allows modification of the list of atoms to be |
|---|
| 3546 | rendered and Compute gives some options for geometric characterization of |
|---|
| 3547 | selected atoms.</p> |
|---|
| 3548 | |
|---|
| 3549 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3550 | |
|---|
| 3551 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3552 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3553 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Atom |
|---|
| 3554 | Selection from table: select individual atoms by a left click of the mouse when |
|---|
| 3555 | pointed at the left most column (atom numbers) of the atom display; hold down |
|---|
| 3556 | the Ctrl key to add to your selection; a previously selected atom will be |
|---|
| 3557 | deselected. A selected atom will be highlighted (in grey) and the atom will be |
|---|
| 3558 | shown in green on the plot. Selection without the Ctrl key will clear previous |
|---|
| 3559 | selections. A double left click in the (empty) upper left box will select or |
|---|
| 3560 | deselect all atoms.</p> |
|---|
| 3561 | |
|---|
| 3562 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3563 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3564 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Atom |
|---|
| 3565 | Selection from plot: select an atom by a left click of the mouse while holding |
|---|
| 3566 | down the Shift key and pointed at the center of the displayed atom, it will |
|---|
| 3567 | turn green if successful and the corresponding entry in the table will be |
|---|
| 3568 | highlighted (in grey); any previous selections will be cleared. To add to .your |
|---|
| 3569 | selection use the right mouse button (Shift down); if a previously selection is |
|---|
| 3570 | reselected it is removed from the selection list. <b style='mso-bidi-font-weight: |
|---|
| 3571 | normal'>NB</b>: beware of atoms that are hiding behind the one you are trying |
|---|
| 3572 | to select, they may be selected inadvertently. You can rotate the structure |
|---|
| 3573 | anytime during the selection process.</p> |
|---|
| 3574 | |
|---|
| 3575 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3576 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 3577 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Double |
|---|
| 3578 | left click a Name, Type and Sym Op column heading: a dialog box is shown that |
|---|
| 3579 | allows you to select all atoms with that characteristic. For example, selecting |
|---|
| 3580 | the Type column will show all the atom types; your choice will then cause all |
|---|
| 3581 | those atoms to be selected.</p> |
|---|
| 3582 | |
|---|
| 3583 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3584 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
|---|
| 3585 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Double |
|---|
| 3586 | left click a Style, Label or Color column: a dialog box is shown that allows |
|---|
| 3587 | you to select a rendering option for all the atoms. For Color a color choice |
|---|
| 3588 | dialog is displayed that covers the entire color spectrum. Choose a color by |
|---|
| 3589 | any of the means available, press the “Add to Custom Colors”, |
|---|
| 3590 | select that color in the Custom colors display and then press OK. <b |
|---|
| 3591 | style='mso-bidi-font-weight:normal'>NB</b>: selecting Color will make all atoms |
|---|
| 3592 | have the same color and for Style “blank” means the atoms |
|---|
| 3593 | aren’t rendered and thus the plot will not show any atoms or bonds!</p> |
|---|
| 3594 | |
|---|
| 3595 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3596 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
|---|
| 3597 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 3598 | ‘<b style='mso-bidi-font-weight:normal'>Edit’ - </b>The edit menu |
|---|
| 3599 | shows operations that can be performed on your selected atoms. You must select |
|---|
| 3600 | one or more atoms before using any of the menu items.</p> |
|---|
| 3601 | |
|---|
| 3602 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3603 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3604 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3605 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3606 | style='mso-bidi-font-weight:normal'>Atom style</b> – select the rendering |
|---|
| 3607 | style for the selected atoms</p> |
|---|
| 3608 | |
|---|
| 3609 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3610 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3611 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3612 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3613 | style='mso-bidi-font-weight:normal'>Atom label</b> – select the item to |
|---|
| 3614 | be shown as a label for each atom in selection. The choices are: none, type, |
|---|
| 3615 | name or number.</p> |
|---|
| 3616 | |
|---|
| 3617 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3618 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3619 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 3620 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3621 | style='mso-bidi-font-weight:normal'>Atom color</b> – select the color for |
|---|
| 3622 | the atom; a color choice dialog is displayed that covers the entire color |
|---|
| 3623 | spectrum. Choose a color by any of the means available, press the “Add to |
|---|
| 3624 | Custom Colors”, select that color in the Custom colors display and then |
|---|
| 3625 | press OK.</p> |
|---|
| 3626 | |
|---|
| 3627 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3628 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3629 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 3630 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3631 | style='mso-bidi-font-weight:normal'>Reset atom colors</b> – return the atom |
|---|
| 3632 | color back to their defaults for the selected atoms.</p> |
|---|
| 3633 | |
|---|
| 3634 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3635 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3636 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 3637 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3638 | style='mso-bidi-font-weight:normal'>View point</b> – position the plot |
|---|
| 3639 | view point to the first atom in the selection.</p> |
|---|
| 3640 | |
|---|
| 3641 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3642 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3643 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
|---|
| 3644 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3645 | style='mso-bidi-font-weight:normal'>Add atoms</b> – using the selected |
|---|
| 3646 | atoms, new ones are added to the bottom of the list after applying your choice |
|---|
| 3647 | of symmetry operator and unit cell translation selected via a dialog display. |
|---|
| 3648 | Duplicate atom positions are not retained. Any anisotropic thermal displacement |
|---|
| 3649 | parameters (<span class=SpellE>Uij</span>) will be transformed as appropriate.</p> |
|---|
| 3650 | |
|---|
| 3651 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3652 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3653 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
|---|
| 3654 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3655 | style='mso-bidi-font-weight:normal'>Transform atoms</b> – apply a |
|---|
| 3656 | symmetry operator and unit cell translation to the set of selected atoms; they |
|---|
| 3657 | will be changed in place. Any anisotropic thermal displacement parameters (<span |
|---|
| 3658 | class=SpellE>Uij</span>) will be transformed as appropriate.</p> |
|---|
| 3659 | |
|---|
| 3660 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3661 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3662 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
|---|
| 3663 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3664 | style='mso-bidi-font-weight:normal'>Fill CN-sphere</b> – using the atoms |
|---|
| 3665 | currently in the draw atom table, find all atoms that belong in the |
|---|
| 3666 | coordination sphere around the selected atoms via unit cell translations. NB: |
|---|
| 3667 | symmetry operations are not used in this search.</p> |
|---|
| 3668 | |
|---|
| 3669 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3670 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3671 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
|---|
| 3672 | style='font:7.0pt "Times New Roman"'> |
|---|
| 3673 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Fill unit |
|---|
| 3674 | cell</b> - using the atoms currently selected from the draw atom table, find |
|---|
| 3675 | all atoms that fall inside or on the edge/surface/corners of the unit cell. |
|---|
| 3676 | This operation is frequently performed before Fill CN-sphere.</p> |
|---|
| 3677 | |
|---|
| 3678 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3679 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
|---|
| 3680 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
|---|
| 3681 | style='font:7.0pt "Times New Roman"'> |
|---|
| 3682 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Delete |
|---|
| 3683 | atoms</b> – clear the entire draw atom table; it is then refilled from |
|---|
| 3684 | the Atoms table. You should do this operation after any changes in the Atoms table, |
|---|
| 3685 | e.g. by a structure refinement.</p> |
|---|
| 3686 | |
|---|
| 3687 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
|---|
| 3688 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>6.<span |
|---|
| 3689 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 3690 | ‘<b style='mso-bidi-font-weight:normal'>Compute’</b> - The compute |
|---|
| 3691 | menu gives a choice of geometric calculations to be performed with the selected |
|---|
| 3692 | atoms. You must select the appropriate number of atoms for these to work and |
|---|
| 3693 | the computation is done for the atoms in selection order.</p> |
|---|
| 3694 | |
|---|
| 3695 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3696 | auto;text-indent:-.25in;mso-list:l13 level1 lfo17'><![if !supportLists]><span |
|---|
| 3697 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3698 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3699 | style='mso-bidi-font-weight:normal'>Dist. Ang.</b> <b style='mso-bidi-font-weight: |
|---|
| 3700 | normal'>Tors. </b>– <span class=GramE>when</span> 2-4 atoms are selected, |
|---|
| 3701 | a distance, angle or torsion angle will be found for them. The angles are |
|---|
| 3702 | computed for the atoms in their selection order. The torsion angle is a right |
|---|
| 3703 | hand angle about the A2-A3 vector for the sequence of atoms A1-A2-A3-A4. An |
|---|
| 3704 | estimated standard deviation is given for the calculated value if a current |
|---|
| 3705 | variance-covariance matrix is available. The result is shown on the console |
|---|
| 3706 | window; it may be cut & pasted to another application (e.g. Microsoft |
|---|
| 3707 | Word).</p> |
|---|
| 3708 | |
|---|
| 3709 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 3710 | text-indent:-.25in;mso-list:l13 level1 lfo17'><![if !supportLists]><span |
|---|
| 3711 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3712 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3713 | style='mso-bidi-font-weight:normal'>Best plane</b> – when 4 or more atoms |
|---|
| 3714 | are selected, a best plane is determined for them. The result is shown on the |
|---|
| 3715 | console window; it may be cut & pasted to another application (e.g. |
|---|
| 3716 | Microsoft Word). Shown are the atom coordinates transformed to Cartesian best |
|---|
| 3717 | plane coordinates where the largest range is over the X-axis and the smallest |
|---|
| 3718 | is over the Z-axis with the origin at the <span class=SpellE>unweighted</span> |
|---|
| 3719 | center of the selection. Root mean square displacements along each axis for the |
|---|
| 3720 | best plane are also listed. The Z-axis RMS value indicates the flatness of the |
|---|
| 3721 | proposed plane. <b style='mso-bidi-font-weight:normal'>NB</b>: if you select |
|---|
| 3722 | (e.g. all) atoms then Best plane will give Cartesian coordinates for these |
|---|
| 3723 | atoms with respect to a coordinate system where the X-axis is along the longest |
|---|
| 3724 | axis of the atom grouping and the Z-axis is along the shortest distance. The |
|---|
| 3725 | origin is at the <span class=SpellE>unweighted</span> center of the selected |
|---|
| 3726 | atoms.</p> |
|---|
| 3727 | |
|---|
| 3728 | <h4><a name=Pawley><u>Pawley </u></a><u>reflections<o:p></o:p></u></h4> |
|---|
| 3729 | |
|---|
| 3730 | <p class=MsoNormal>This gives the list of reflections used in a Pawley |
|---|
| 3731 | refinement and can only be seen if the phase type is ‘Pawley’ (see<span |
|---|
| 3732 | style='color:#00B0F0'> </span><a href="#General">General</a>)<span |
|---|
| 3733 | style='color:#00B0F0'>.</span></p> |
|---|
| 3734 | |
|---|
| 3735 | <h5>What can I do here?</h5> |
|---|
| 3736 | |
|---|
| 3737 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
|---|
| 3738 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3739 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 3740 | <b style='mso-bidi-font-weight:normal'>‘Operations’</b> –</p> |
|---|
| 3741 | |
|---|
| 3742 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3743 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
|---|
| 3744 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3745 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3746 | style='mso-bidi-font-weight:normal'>Pawley create</b> – this creates a |
|---|
| 3747 | new set of Pawley reflections, over writing any preexisting Pawley set. They |
|---|
| 3748 | are generated with d-<span class=SpellE>spacings</span> larger than the limit |
|---|
| 3749 | set as ‘Pawley <span class=SpellE>dmin</span>’ in the General tab |
|---|
| 3750 | for this phase. By default the refine flags are not set and the <span |
|---|
| 3751 | class=SpellE><span class=GramE>Fsq</span></span><span class=GramE>(</span><span |
|---|
| 3752 | class=SpellE>hkl</span>) = 100.0.</p> |
|---|
| 3753 | |
|---|
| 3754 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3755 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
|---|
| 3756 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3757 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3758 | style='mso-bidi-font-weight:normal'>Pawley estimate</b> – this attempts |
|---|
| 3759 | an estimate of <span class=SpellE><span class=GramE>Fsq</span></span><span |
|---|
| 3760 | class=GramE>(</span><span class=SpellE>hkl</span>) from the peak heights of the |
|---|
| 3761 | reflection as seen in the 1<sup>st</sup> powder pattern of those selected in |
|---|
| 3762 | the <a href="#Data">Data</a> tab.</p> |
|---|
| 3763 | |
|---|
| 3764 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3765 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
|---|
| 3766 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 3767 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3768 | style='mso-bidi-font-weight:normal'>Pawley delete </b>– this clears the |
|---|
| 3769 | set of Pawley reflections.</p> |
|---|
| 3770 | |
|---|
| 3771 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
|---|
| 3772 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3773 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>You |
|---|
| 3774 | can change the refine flags either by clicking on the box or by selecting one |
|---|
| 3775 | and then selecting the column (a single click on the column heading). Then type |
|---|
| 3776 | ‘y’ to set the refine flags or ‘n’ to clear the flags. |
|---|
| 3777 | You should deselect those reflections that fall below the lower limit or above |
|---|
| 3778 | the upper limit of the powder pattern otherwise you may have a singular matrix |
|---|
| 3779 | error in your Pawley refinement.</p> |
|---|
| 3780 | |
|---|
| 3781 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
|---|
| 3782 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 3783 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>You |
|---|
| 3784 | can change the individual <span class=SpellE><span class=GramE>Fsq</span></span><span |
|---|
| 3785 | class=GramE>(</span><span class=SpellE>hkl</span>) values by selecting it, |
|---|
| 3786 | typing in the new value and then pressing enter or selecting somewhere else in |
|---|
| 3787 | the table.</p> |
|---|
| 3788 | |
|---|
| 3789 | <p class=MsoListParagraphCxSpLast><o:p> </o:p></p> |
|---|
| 3790 | |
|---|
| 3791 | <h4><a name="Map_peaks">Map peaks</a></h4> |
|---|
| 3792 | |
|---|
| 3793 | <span style='mso-bookmark:Map_peaks'></span> |
|---|
| 3794 | |
|---|
| 3795 | <p class=MsoNormal>This gives the list (magnitude, x y & z) of all peaks |
|---|
| 3796 | found within the unit cell from the last Fourier map search sorted in order of |
|---|
| 3797 | decreasing peak magnitude. The crystal structure plot shows each peak position |
|---|
| 3798 | as a white 3-D cross.</p> |
|---|
| 3799 | |
|---|
| 3800 | <h5>What can I do here?</h5> |
|---|
| 3801 | |
|---|
| 3802 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l22 level1 lfo20'><![if !supportLists]><span |
|---|
| 3803 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3804 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Select |
|---|
| 3805 | a peak with a left click on the left hand row number, hold Ctrl key down to add |
|---|
| 3806 | more peaks to your selection. Each peak selected will show as a green 3-D cross |
|---|
| 3807 | on the crystal structure plot.</p> |
|---|
| 3808 | |
|---|
| 3809 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l22 level1 lfo20'><![if !supportLists]><span |
|---|
| 3810 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3811 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
|---|
| 3812 | <b style='mso-bidi-font-weight:normal'>‘Map peaks’ </b><span |
|---|
| 3813 | style='mso-spacerun:yes'> </span>–</p> |
|---|
| 3814 | |
|---|
| 3815 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3816 | auto;text-indent:-.25in;mso-list:l22 level2 lfo20;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3817 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3818 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3819 | style='mso-bidi-font-weight:normal'>Move peaks</b> – this copies selected |
|---|
| 3820 | peaks to the <a href="gsasII.html">Atoms</a> list and the <a href="gsasII.html">Draw |
|---|
| 3821 | Atoms</a> list. They will be appended to the end of each list each with the |
|---|
| 3822 | name ‘UNK’ and the atom type as ‘H’. They will also be |
|---|
| 3823 | drawn as small white spheres at their respective positions in the structure |
|---|
| 3824 | drawing. You should next go to the <a href="gsasII.html">Atoms</a> page and |
|---|
| 3825 | change the atom type to whatever element you desire; it will be renamed |
|---|
| 3826 | automatically.</p> |
|---|
| 3827 | |
|---|
| 3828 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
|---|
| 3829 | text-indent:-.25in;mso-list:l22 level2 lfo20;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3830 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3831 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 3832 | style='mso-bidi-font-weight:normal'>Clear peaks </b>– this deletes all |
|---|
| 3833 | the peaks in the map peak list; they are also removed from the crystal |
|---|
| 3834 | structure drawing plot.</p> |
|---|
| 3835 | |
|---|
| 3836 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 3837 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3838 | |
|---|
| 3839 | <hr size=2 width="100%" align=center> |
|---|
| 3840 | |
|---|
| 3841 | </span></div> |
|---|
| 3842 | |
|---|
| 3843 | <div class=MsoNormal align=center style='text-align:center'><span |
|---|
| 3844 | style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 3845 | |
|---|
| 3846 | <hr size=2 width="100%" align=center> |
|---|
| 3847 | |
|---|
| 3848 | </span></div> |
|---|
| 3849 | |
|---|
| 3850 | <h2><a name=Plots><span style='mso-fareast-font-family:"Times New Roman"'>3. |
|---|
| 3851 | GSAS-II Plots Window</span></a><span style='mso-bookmark:Plots'></span><span |
|---|
| 3852 | style='mso-fareast-font-family:"Times New Roman";font-weight:normal'> </span><span |
|---|
| 3853 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h2> |
|---|
| 3854 | |
|---|
| 3855 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
|---|
| 3856 | window presents all the graphical material as a multipage tabbed set of plots |
|---|
| 3857 | utilizing the <span class=SpellE>matplotlib</span> python package. Each page |
|---|
| 3858 | has a tool bar (at bottom in Windows) with the controls<o:p></o:p></span></p> |
|---|
| 3859 | |
|---|
| 3860 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"; |
|---|
| 3861 | mso-no-proof:yes'><img border=0 width=225 height=31 id="_x0000_i1032" |
|---|
| 3862 | src=graphbar.jpg |
|---|
| 3863 | alt="Description: Description: Description: Description: Description: Description: Description: Description: Description: Description: D:\pyGSAS\help\graphbar.jpg"></span><span |
|---|
| 3864 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></p> |
|---|
| 3865 | |
|---|
| 3866 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>These |
|---|
| 3867 | are Home, Back, Forward, Pan, Zoom, Save and Help, respectively. <o:p></o:p></span></p> |
|---|
| 3868 | |
|---|
| 3869 | <ul type=disc> |
|---|
| 3870 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3871 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3872 | "Times New Roman"'>Home: returns the plot to the initial scaling <o:p></o:p></span></li> |
|---|
| 3873 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3874 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3875 | "Times New Roman"'>Back: returns the plot to the previous scaling <o:p></o:p></span></li> |
|---|
| 3876 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3877 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3878 | "Times New Roman"'>Forward: reverses the action in the previous press(es) |
|---|
| 3879 | of the Back button <o:p></o:p></span></li> |
|---|
| 3880 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3881 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3882 | "Times New Roman"'>Pan: allows you to control panning across the plot |
|---|
| 3883 | (press left mouse button) and zooming (press right mouse button), <o:p></o:p></span></li> |
|---|
| 3884 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3885 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3886 | "Times New Roman"'>Zoom: allows you to select a portion of the plot (press |
|---|
| 3887 | right mouse button & drag for zoom box) for the next plot. <o:p></o:p></span></li> |
|---|
| 3888 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3889 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3890 | "Times New Roman"'>Save: allows you to save the currently displayed plot |
|---|
| 3891 | in one of several graphical formats suitable for printing or insertion in |
|---|
| 3892 | a document.<o:p></o:p></span></li> |
|---|
| 3893 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
|---|
| 3894 | mso-list:l1 level1 lfo21;tab-stops:list .5in'><span style='mso-fareast-font-family: |
|---|
| 3895 | "Times New Roman"'>Help: accesses GSASII help on the specific plot type. <o:p></o:p></span></li> |
|---|
| 3896 | </ul> |
|---|
| 3897 | |
|---|
| 3898 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
|---|
| 3899 | |
|---|
| 3900 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Below |
|---|
| 3901 | the toolbar may be a status bar that on the left may show either an instruction |
|---|
| 3902 | for a keyed input or a pull down selection of keyed input; on the right may be |
|---|
| 3903 | displayed position dependent information that is updated as the mouse is moved |
|---|
| 3904 | over the plot region.<o:p></o:p></span></p> |
|---|
| 3905 | |
|---|
| 3906 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
|---|
| 3907 | |
|---|
| 3908 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
|---|
| 3909 | specific types of plots that are pages in the GSASII Plots windows are next.<o:p></o:p></span></p> |
|---|
| 3910 | |
|---|
| 3911 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Powder Patterns<o:p></o:p></span></h4> |
|---|
| 3912 | |
|---|
| 3913 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
|---|
| 3914 | powder patterns that are part of your project are shown on this page. They can |
|---|
| 3915 | be displayed as a stack of powder patterns, just a single pattern or as a |
|---|
| 3916 | contour image of the peak intensities. What can be done here will depend on |
|---|
| 3917 | which is displayed and on which item in the GSAS-II data tree you have |
|---|
| 3918 | selected.<o:p></o:p></span></p> |
|---|
| 3919 | |
|---|
| 3920 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
|---|
| 3921 | |
|---|
| 3922 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l4 level1 lfo22'><![if !supportLists]><span |
|---|
| 3923 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
|---|
| 3924 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3925 | style='mso-fareast-font-family:"Times New Roman"'>Move the mouse cursor across |
|---|
| 3926 | the plot, the plot status line will show the cursor position in 2</span><span |
|---|
| 3927 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>Q</span><span |
|---|
| 3928 | style='mso-fareast-font-family:"Times New Roman"'>, d-spacing and the |
|---|
| 3929 | intensity. For a q-plot, q is shown instead of 2</span><span style='font-family: |
|---|
| 3930 | Symbol;mso-fareast-font-family:"Times New Roman"'>Q</span><span |
|---|
| 3931 | style='mso-fareast-font-family:"Times New Roman"'>.<o:p></o:p></span></p> |
|---|
| 3932 | |
|---|
| 3933 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo22'><![if !supportLists]><span |
|---|
| 3934 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
|---|
| 3935 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>On |
|---|
| 3936 | the plot status line<b style='mso-bidi-font-weight:normal'> ‘key |
|---|
| 3937 | press’ </b>– you can either press the key on the key board or |
|---|
| 3938 | select from the pull down menu. For line plots:</p> |
|---|
| 3939 | |
|---|
| 3940 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3941 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3942 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 3943 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3944 | class=GramE><b style='mso-bidi-font-weight:normal'>l</b></span><b |
|---|
| 3945 | style='mso-bidi-font-weight:normal'>: offset left</b> – for a waterfall |
|---|
| 3946 | plot of multiple powder profiles, increase the offset to the left. Does not |
|---|
| 3947 | apply if only one pattern.</p> |
|---|
| 3948 | |
|---|
| 3949 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3950 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3951 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 3952 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3953 | class=GramE><b style='mso-bidi-font-weight:normal'>r</b></span><b |
|---|
| 3954 | style='mso-bidi-font-weight:normal'>: offset right</b> - for a waterfall plot of |
|---|
| 3955 | multiple powder profiles, increase the offset to the left. Does not apply if |
|---|
| 3956 | only one pattern.</p> |
|---|
| 3957 | |
|---|
| 3958 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3959 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3960 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 3961 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3962 | class=GramE><b style='mso-bidi-font-weight:normal'>d</b></span><b |
|---|
| 3963 | style='mso-bidi-font-weight:normal'>: offset down</b> - for a waterfall plot of |
|---|
| 3964 | multiple powder profiles, increase the offset down. Does not apply if only one |
|---|
| 3965 | pattern.</p> |
|---|
| 3966 | |
|---|
| 3967 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3968 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3969 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 3970 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3971 | class=GramE><b style='mso-bidi-font-weight:normal'>u</b></span><b |
|---|
| 3972 | style='mso-bidi-font-weight:normal'>: offset up</b> - for a waterfall plot of |
|---|
| 3973 | multiple powder profiles, increase the offset up. Does not apply if only one |
|---|
| 3974 | pattern.</p> |
|---|
| 3975 | |
|---|
| 3976 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3977 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3978 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 3979 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3980 | class=GramE><b style='mso-bidi-font-weight:normal'>o</b></span><b |
|---|
| 3981 | style='mso-bidi-font-weight:normal'>: reset offset</b> - for a waterfall plot |
|---|
| 3982 | of multiple powder profiles, reset to no offset. Does not apply if only one |
|---|
| 3983 | pattern.</p> |
|---|
| 3984 | |
|---|
| 3985 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3986 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3987 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
|---|
| 3988 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3989 | class=GramE><b style='mso-bidi-font-weight:normal'>n</b></span><b |
|---|
| 3990 | style='mso-bidi-font-weight:normal'>: log(I) on/off</b> – changes the |
|---|
| 3991 | y-axis to be the log10 of the intensity; difference curve is not shown for |
|---|
| 3992 | log(I) on.</p> |
|---|
| 3993 | |
|---|
| 3994 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 3995 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 3996 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
|---|
| 3997 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 3998 | class=GramE><b style='mso-bidi-font-weight:normal'>c</b></span><b |
|---|
| 3999 | style='mso-bidi-font-weight:normal'>: contour on/off</b> – if multiple |
|---|
| 4000 | powder profiles, then a contour plot is shown of the observed intensities. All |
|---|
| 4001 | data sets must be the same length as the first one to be included in the |
|---|
| 4002 | contour plot.</p> |
|---|
| 4003 | |
|---|
| 4004 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4005 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4006 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
|---|
| 4007 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 4008 | style='mso-bidi-font-weight:normal'>q: toggle q plot</b> – changes the |
|---|
| 4009 | x-axis from 2<span style='font-family:Symbol'>Q</span> to q=2<span |
|---|
| 4010 | style='font-family:Symbol'>p</span>/d. This will put multiple powder patterns |
|---|
| 4011 | taken at different energies on the same x-axis scale.</p> |
|---|
| 4012 | |
|---|
| 4013 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4014 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4015 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
|---|
| 4016 | style='font:7.0pt "Times New Roman"'> |
|---|
| 4017 | </span></span></span><![endif]><span class=GramE><b style='mso-bidi-font-weight: |
|---|
| 4018 | normal'>s</b></span><b style='mso-bidi-font-weight:normal'>: toggle single plot</b> |
|---|
| 4019 | – for multiple powder profiles, this will show only the one selected from |
|---|
| 4020 | the data tree. The offset options are not active.</p> |
|---|
| 4021 | |
|---|
| 4022 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4023 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4024 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
|---|
| 4025 | style='font:7.0pt "Times New Roman"'> |
|---|
| 4026 | </span></span></span><![endif]><span class=GramE><b style='mso-bidi-font-weight: |
|---|
| 4027 | normal'>w</b></span><b style='mso-bidi-font-weight:normal'>: toggle divide by |
|---|
| 4028 | sig</b> – for the pattern selected from the data tree, this will divide |
|---|
| 4029 | the observed, calculated and difference curves by the <span class=SpellE>esd</span> |
|---|
| 4030 | for the data points. Other data sets are not shown.</p> |
|---|
| 4031 | |
|---|
| 4032 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4033 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4034 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>k.<span |
|---|
| 4035 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 4036 | style='mso-bidi-font-weight:normal'>+: no selection</b> - for multiple powder |
|---|
| 4037 | profiles, only the observed curve is shown.</p> |
|---|
| 4038 | |
|---|
| 4039 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo22'><![if !supportLists]><span |
|---|
| 4040 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
|---|
| 4041 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 4042 | style='mso-fareast-font-family:"Times New Roman"'>For contour plots the status |
|---|
| 4043 | line ‘key press’ options are different:<o:p></o:p></span></p> |
|---|
| 4044 | |
|---|
| 4045 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4046 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4047 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
|---|
| 4048 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 4049 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 4050 | "Times New Roman"'>d</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 4051 | style='mso-fareast-font-family:"Times New Roman"'>: lower contour max</span></b><span |
|---|
| 4052 | style='mso-fareast-font-family:"Times New Roman"'> – this lowers the |
|---|
| 4053 | level chosen for the highest contour color.<o:p></o:p></span></p> |
|---|
| 4054 | |
|---|
| 4055 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4056 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4057 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
|---|
| 4058 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
|---|
| 4059 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>u: |
|---|
| 4060 | raise contour max</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
|---|
| 4061 | – this raises the level chosen for the highest contour color<o:p></o:p></span></p> |
|---|
| 4062 | |
|---|
| 4063 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4064 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4065 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
|---|
| 4066 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 4067 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 4068 | "Times New Roman"'>i</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 4069 | style='mso-fareast-font-family:"Times New Roman"'>: interpolation method</span></b><span |
|---|
| 4070 | style='mso-fareast-font-family:"Times New Roman"'> – this changes the |
|---|
| 4071 | method used to represent the contours. If selected a dialog box appears with |
|---|
| 4072 | all the possible choices. Default is ‘nearest’; the other useful |
|---|
| 4073 | choice is ‘bilinear’, this will smooth out the contours. <o:p></o:p></span></p> |
|---|
| 4074 | |
|---|
| 4075 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4076 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4077 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
|---|
| 4078 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 4079 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 4080 | "Times New Roman"'>s</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 4081 | style='mso-fareast-font-family:"Times New Roman"'>: color scheme</span></b><span |
|---|
| 4082 | style='mso-fareast-font-family:"Times New Roman"'> – this changes the |
|---|
| 4083 | color scheme for the contouring. Default is <span class=GramE>‘Paired’,</span> |
|---|
| 4084 | black/ white options are ‘Greys’ and ‘binary’ (for |
|---|
| 4085 | black on white) or ‘gray’ (for white on black). Others can be very |
|---|
| 4086 | colorful (but not useful)!<o:p></o:p></span></p> |
|---|
| 4087 | |
|---|
| 4088 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
|---|
| 4089 | auto;text-indent:-.25in;mso-list:l4 level2 lfo22;tab-stops:list 1.0in'><![if !supportLists]><span |
|---|
| 4090 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
|---|
| 4091 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
|---|
| 4092 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
|---|
| 4093 | "Times New Roman"'>c</span></b></span><b style='mso-bidi-font-weight:normal'><span |
|---|
| 4094 | style='mso-fareast-font-family:"Times New Roman"'>: contour off/on</span></b><span |
|---|
| 4095 | style='mso-fareast-font-family:"Times New Roman"'> – this turns off |
|---|
| 4096 | contouring and returns to a waterfall plot with any offsets applied.<o:p></o:p></span></p> |
|---|
| 4097 | |
|---|
| 4098 | <p class |
|---|
