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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:Wingdings; |
---|
351 | panose-1:5 0 0 0 0 0 0 0 0 0; |
---|
352 | mso-font-charset:2; |
---|
353 | mso-generic-font-family:auto; |
---|
354 | mso-font-pitch:variable; |
---|
355 | mso-font-signature:0 268435456 0 0 -2147483648 0;} |
---|
356 | @font-face |
---|
357 | {font-family:"Cambria Math"; |
---|
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 1107305727 0 0 415 0;} |
---|
363 | @font-face |
---|
364 | {font-family:Cambria; |
---|
365 | panose-1:2 4 5 3 5 4 6 3 2 4; |
---|
366 | mso-font-charset:0; |
---|
367 | mso-generic-font-family:roman; |
---|
368 | mso-font-pitch:variable; |
---|
369 | mso-font-signature:-536870145 1073743103 0 0 415 0;} |
---|
370 | @font-face |
---|
371 | {font-family:Tahoma; |
---|
372 | panose-1:2 11 6 4 3 5 4 4 2 4; |
---|
373 | mso-font-charset:0; |
---|
374 | mso-generic-font-family:swiss; |
---|
375 | mso-font-pitch:variable; |
---|
376 | mso-font-signature:-520081665 -1073717157 41 0 66047 0;} |
---|
377 | /* Style Definitions */ |
---|
378 | p.MsoNormal, li.MsoNormal, div.MsoNormal |
---|
379 | {mso-style-unhide:no; |
---|
380 | mso-style-qformat:yes; |
---|
381 | mso-style-parent:""; |
---|
382 | margin:0in; |
---|
383 | margin-bottom:.0001pt; |
---|
384 | mso-pagination:widow-orphan; |
---|
385 | font-size:12.0pt; |
---|
386 | font-family:"Times New Roman","serif"; |
---|
387 | mso-fareast-font-family:"Times New Roman"; |
---|
388 | mso-fareast-theme-font:minor-fareast;} |
---|
389 | h1 |
---|
390 | {mso-style-priority:9; |
---|
391 | mso-style-unhide:no; |
---|
392 | mso-style-qformat:yes; |
---|
393 | mso-style-link:"Heading 1 Char"; |
---|
394 | mso-margin-top-alt:auto; |
---|
395 | margin-right:0in; |
---|
396 | mso-margin-bottom-alt:auto; |
---|
397 | margin-left:0in; |
---|
398 | mso-pagination:widow-orphan; |
---|
399 | mso-outline-level:1; |
---|
400 | font-size:24.0pt; |
---|
401 | font-family:"Times New Roman","serif"; |
---|
402 | mso-fareast-font-family:"Times New Roman"; |
---|
403 | mso-fareast-theme-font:minor-fareast; |
---|
404 | font-weight:bold;} |
---|
405 | h2 |
---|
406 | {mso-style-priority:9; |
---|
407 | mso-style-unhide:no; |
---|
408 | mso-style-qformat:yes; |
---|
409 | mso-style-link:"Heading 2 Char"; |
---|
410 | mso-margin-top-alt:auto; |
---|
411 | margin-right:0in; |
---|
412 | mso-margin-bottom-alt:auto; |
---|
413 | margin-left:0in; |
---|
414 | mso-pagination:widow-orphan; |
---|
415 | mso-outline-level:2; |
---|
416 | font-size:18.0pt; |
---|
417 | font-family:"Times New Roman","serif"; |
---|
418 | mso-fareast-font-family:"Times New Roman"; |
---|
419 | mso-fareast-theme-font:minor-fareast; |
---|
420 | font-weight:bold;} |
---|
421 | h3 |
---|
422 | {mso-style-priority:9; |
---|
423 | mso-style-unhide:no; |
---|
424 | mso-style-qformat:yes; |
---|
425 | mso-style-link:"Heading 3 Char"; |
---|
426 | mso-margin-top-alt:auto; |
---|
427 | margin-right:0in; |
---|
428 | mso-margin-bottom-alt:auto; |
---|
429 | margin-left:0in; |
---|
430 | mso-pagination:widow-orphan; |
---|
431 | mso-outline-level:3; |
---|
432 | font-size:13.5pt; |
---|
433 | font-family:"Times New Roman","serif"; |
---|
434 | mso-fareast-font-family:"Times New Roman"; |
---|
435 | mso-fareast-theme-font:minor-fareast; |
---|
436 | font-weight:bold;} |
---|
437 | h4 |
---|
438 | {mso-style-noshow:yes; |
---|
439 | mso-style-priority:9; |
---|
440 | mso-style-qformat:yes; |
---|
441 | mso-style-link:"Heading 4 Char"; |
---|
442 | mso-style-next:Normal; |
---|
443 | margin-top:10.0pt; |
---|
444 | margin-right:0in; |
---|
445 | margin-bottom:0in; |
---|
446 | margin-left:0in; |
---|
447 | margin-bottom:.0001pt; |
---|
448 | mso-pagination:widow-orphan lines-together; |
---|
449 | page-break-after:avoid; |
---|
450 | mso-outline-level:4; |
---|
451 | font-size:13.0pt; |
---|
452 | font-family:"Cambria","serif"; |
---|
453 | mso-ascii-font-family:Cambria; |
---|
454 | mso-ascii-theme-font:major-latin; |
---|
455 | mso-fareast-font-family:"Times New Roman"; |
---|
456 | mso-fareast-theme-font:major-fareast; |
---|
457 | mso-hansi-font-family:Cambria; |
---|
458 | mso-hansi-theme-font:major-latin; |
---|
459 | mso-bidi-font-family:"Times New Roman"; |
---|
460 | mso-bidi-theme-font:major-bidi; |
---|
461 | color:#4F81BD; |
---|
462 | mso-themecolor:accent1; |
---|
463 | font-weight:bold; |
---|
464 | font-style:italic;} |
---|
465 | h5 |
---|
466 | {mso-style-noshow:yes; |
---|
467 | mso-style-priority:9; |
---|
468 | mso-style-qformat:yes; |
---|
469 | mso-style-link:"Heading 5 Char"; |
---|
470 | mso-margin-top-alt:auto; |
---|
471 | margin-right:0in; |
---|
472 | mso-margin-bottom-alt:auto; |
---|
473 | margin-left:0in; |
---|
474 | mso-pagination:widow-orphan; |
---|
475 | mso-outline-level:5; |
---|
476 | font-size:12.0pt; |
---|
477 | font-family:"Times New Roman","serif"; |
---|
478 | mso-fareast-font-family:"Times New Roman"; |
---|
479 | mso-fareast-theme-font:minor-fareast; |
---|
480 | color:#4F4FFF; |
---|
481 | font-weight:bold;} |
---|
482 | a:link, span.MsoHyperlink |
---|
483 | {mso-style-noshow:yes; |
---|
484 | mso-style-priority:99; |
---|
485 | color:blue; |
---|
486 | text-decoration:underline; |
---|
487 | text-underline:single;} |
---|
488 | a:visited, span.MsoHyperlinkFollowed |
---|
489 | {mso-style-noshow:yes; |
---|
490 | mso-style-priority:99; |
---|
491 | color:purple; |
---|
492 | text-decoration:underline; |
---|
493 | text-underline:single;} |
---|
494 | p |
---|
495 | {mso-style-noshow:yes; |
---|
496 | mso-style-priority:99; |
---|
497 | mso-margin-top-alt:auto; |
---|
498 | margin-right:0in; |
---|
499 | mso-margin-bottom-alt:auto; |
---|
500 | margin-left:0in; |
---|
501 | mso-pagination:widow-orphan; |
---|
502 | font-size:12.0pt; |
---|
503 | font-family:"Times New Roman","serif"; |
---|
504 | mso-fareast-font-family:"Times New Roman"; |
---|
505 | mso-fareast-theme-font:minor-fareast;} |
---|
506 | pre |
---|
507 | {mso-style-noshow:yes; |
---|
508 | mso-style-priority:99; |
---|
509 | mso-style-link:"HTML Preformatted Char"; |
---|
510 | margin:0in; |
---|
511 | margin-bottom:.0001pt; |
---|
512 | mso-pagination:widow-orphan; |
---|
513 | 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; |
---|
514 | font-size:10.0pt; |
---|
515 | font-family:"Courier New"; |
---|
516 | mso-fareast-font-family:"Times New Roman";} |
---|
517 | p.MsoAcetate, li.MsoAcetate, div.MsoAcetate |
---|
518 | {mso-style-noshow:yes; |
---|
519 | mso-style-priority:99; |
---|
520 | mso-style-link:"Balloon Text Char"; |
---|
521 | margin:0in; |
---|
522 | margin-bottom:.0001pt; |
---|
523 | mso-pagination:widow-orphan; |
---|
524 | font-size:8.0pt; |
---|
525 | font-family:"Tahoma","sans-serif"; |
---|
526 | mso-fareast-font-family:"Times New Roman"; |
---|
527 | mso-fareast-theme-font:minor-fareast;} |
---|
528 | span.MsoPlaceholderText |
---|
529 | {mso-style-noshow:yes; |
---|
530 | mso-style-priority:99; |
---|
531 | mso-style-unhide:no; |
---|
532 | color:gray;} |
---|
533 | p.MsoListParagraph, li.MsoListParagraph, div.MsoListParagraph |
---|
534 | {mso-style-noshow:yes; |
---|
535 | mso-style-priority:34; |
---|
536 | mso-style-unhide:no; |
---|
537 | mso-style-qformat:yes; |
---|
538 | margin-top:0in; |
---|
539 | margin-right:0in; |
---|
540 | margin-bottom:0in; |
---|
541 | margin-left:.5in; |
---|
542 | margin-bottom:.0001pt; |
---|
543 | mso-add-space:auto; |
---|
544 | mso-pagination:widow-orphan; |
---|
545 | font-size:12.0pt; |
---|
546 | font-family:"Times New Roman","serif"; |
---|
547 | mso-fareast-font-family:"Times New Roman"; |
---|
548 | mso-fareast-theme-font:minor-fareast;} |
---|
549 | p.MsoListParagraphCxSpFirst, li.MsoListParagraphCxSpFirst, div.MsoListParagraphCxSpFirst |
---|
550 | {mso-style-noshow:yes; |
---|
551 | mso-style-priority:34; |
---|
552 | mso-style-unhide:no; |
---|
553 | mso-style-qformat:yes; |
---|
554 | mso-style-type:export-only; |
---|
555 | margin-top:0in; |
---|
556 | margin-right:0in; |
---|
557 | margin-bottom:0in; |
---|
558 | margin-left:.5in; |
---|
559 | margin-bottom:.0001pt; |
---|
560 | mso-add-space:auto; |
---|
561 | mso-pagination:widow-orphan; |
---|
562 | font-size:12.0pt; |
---|
563 | font-family:"Times New Roman","serif"; |
---|
564 | mso-fareast-font-family:"Times New Roman"; |
---|
565 | mso-fareast-theme-font:minor-fareast;} |
---|
566 | p.MsoListParagraphCxSpMiddle, li.MsoListParagraphCxSpMiddle, div.MsoListParagraphCxSpMiddle |
---|
567 | {mso-style-noshow:yes; |
---|
568 | mso-style-priority:34; |
---|
569 | mso-style-unhide:no; |
---|
570 | mso-style-qformat:yes; |
---|
571 | mso-style-type:export-only; |
---|
572 | margin-top:0in; |
---|
573 | margin-right:0in; |
---|
574 | margin-bottom:0in; |
---|
575 | margin-left:.5in; |
---|
576 | margin-bottom:.0001pt; |
---|
577 | mso-add-space:auto; |
---|
578 | mso-pagination:widow-orphan; |
---|
579 | font-size:12.0pt; |
---|
580 | font-family:"Times New Roman","serif"; |
---|
581 | mso-fareast-font-family:"Times New Roman"; |
---|
582 | mso-fareast-theme-font:minor-fareast;} |
---|
583 | p.MsoListParagraphCxSpLast, li.MsoListParagraphCxSpLast, div.MsoListParagraphCxSpLast |
---|
584 | {mso-style-noshow:yes; |
---|
585 | mso-style-priority:34; |
---|
586 | mso-style-unhide:no; |
---|
587 | mso-style-qformat:yes; |
---|
588 | mso-style-type:export-only; |
---|
589 | margin-top:0in; |
---|
590 | margin-right:0in; |
---|
591 | margin-bottom:0in; |
---|
592 | margin-left:.5in; |
---|
593 | margin-bottom:.0001pt; |
---|
594 | mso-add-space:auto; |
---|
595 | mso-pagination:widow-orphan; |
---|
596 | font-size:12.0pt; |
---|
597 | font-family:"Times New Roman","serif"; |
---|
598 | mso-fareast-font-family:"Times New Roman"; |
---|
599 | mso-fareast-theme-font:minor-fareast;} |
---|
600 | span.Heading1Char |
---|
601 | {mso-style-name:"Heading 1 Char"; |
---|
602 | mso-style-priority:9; |
---|
603 | mso-style-unhide:no; |
---|
604 | mso-style-locked:yes; |
---|
605 | mso-style-link:"Heading 1"; |
---|
606 | mso-ansi-font-size:14.0pt; |
---|
607 | mso-bidi-font-size:14.0pt; |
---|
608 | font-family:"Cambria","serif"; |
---|
609 | mso-ascii-font-family:Cambria; |
---|
610 | mso-ascii-theme-font:major-latin; |
---|
611 | mso-fareast-font-family:"Times New Roman"; |
---|
612 | mso-fareast-theme-font:major-fareast; |
---|
613 | mso-hansi-font-family:Cambria; |
---|
614 | mso-hansi-theme-font:major-latin; |
---|
615 | mso-bidi-font-family:"Times New Roman"; |
---|
616 | mso-bidi-theme-font:major-bidi; |
---|
617 | color:#365F91; |
---|
618 | mso-themecolor:accent1; |
---|
619 | mso-themeshade:191; |
---|
620 | font-weight:bold;} |
---|
621 | span.Heading2Char |
---|
622 | {mso-style-name:"Heading 2 Char"; |
---|
623 | mso-style-noshow:yes; |
---|
624 | mso-style-priority:9; |
---|
625 | mso-style-unhide:no; |
---|
626 | mso-style-locked:yes; |
---|
627 | mso-style-link:"Heading 2"; |
---|
628 | mso-ansi-font-size:13.0pt; |
---|
629 | mso-bidi-font-size:13.0pt; |
---|
630 | font-family:"Cambria","serif"; |
---|
631 | mso-ascii-font-family:Cambria; |
---|
632 | mso-ascii-theme-font:major-latin; |
---|
633 | mso-fareast-font-family:"Times New Roman"; |
---|
634 | mso-fareast-theme-font:major-fareast; |
---|
635 | mso-hansi-font-family:Cambria; |
---|
636 | mso-hansi-theme-font:major-latin; |
---|
637 | mso-bidi-font-family:"Times New Roman"; |
---|
638 | mso-bidi-theme-font:major-bidi; |
---|
639 | color:#4F81BD; |
---|
640 | mso-themecolor:accent1; |
---|
641 | font-weight:bold;} |
---|
642 | span.Heading3Char |
---|
643 | {mso-style-name:"Heading 3 Char"; |
---|
644 | mso-style-noshow:yes; |
---|
645 | mso-style-priority:9; |
---|
646 | mso-style-unhide:no; |
---|
647 | mso-style-locked:yes; |
---|
648 | mso-style-link:"Heading 3"; |
---|
649 | mso-ansi-font-size:12.0pt; |
---|
650 | mso-bidi-font-size:12.0pt; |
---|
651 | font-family:"Cambria","serif"; |
---|
652 | mso-ascii-font-family:Cambria; |
---|
653 | mso-ascii-theme-font:major-latin; |
---|
654 | mso-fareast-font-family:"Times New Roman"; |
---|
655 | mso-fareast-theme-font:major-fareast; |
---|
656 | mso-hansi-font-family:Cambria; |
---|
657 | mso-hansi-theme-font:major-latin; |
---|
658 | mso-bidi-font-family:"Times New Roman"; |
---|
659 | mso-bidi-theme-font:major-bidi; |
---|
660 | color:#4F81BD; |
---|
661 | mso-themecolor:accent1; |
---|
662 | font-weight:bold;} |
---|
663 | span.Heading4Char |
---|
664 | {mso-style-name:"Heading 4 Char"; |
---|
665 | mso-style-noshow:yes; |
---|
666 | mso-style-priority:9; |
---|
667 | mso-style-unhide:no; |
---|
668 | mso-style-locked:yes; |
---|
669 | mso-style-link:"Heading 4"; |
---|
670 | mso-ansi-font-size:12.0pt; |
---|
671 | mso-bidi-font-size:12.0pt; |
---|
672 | font-family:"Cambria","serif"; |
---|
673 | mso-ascii-font-family:Cambria; |
---|
674 | mso-ascii-theme-font:major-latin; |
---|
675 | mso-fareast-font-family:"Times New Roman"; |
---|
676 | mso-fareast-theme-font:major-fareast; |
---|
677 | mso-hansi-font-family:Cambria; |
---|
678 | mso-hansi-theme-font:major-latin; |
---|
679 | mso-bidi-font-family:"Times New Roman"; |
---|
680 | mso-bidi-theme-font:major-bidi; |
---|
681 | color:#4F81BD; |
---|
682 | mso-themecolor:accent1; |
---|
683 | font-weight:bold; |
---|
684 | font-style:italic;} |
---|
685 | span.Heading5Char |
---|
686 | {mso-style-name:"Heading 5 Char"; |
---|
687 | mso-style-noshow:yes; |
---|
688 | mso-style-priority:9; |
---|
689 | mso-style-unhide:no; |
---|
690 | mso-style-locked:yes; |
---|
691 | mso-style-link:"Heading 5"; |
---|
692 | mso-ansi-font-size:12.0pt; |
---|
693 | mso-bidi-font-size:12.0pt; |
---|
694 | font-family:"Cambria","serif"; |
---|
695 | mso-ascii-font-family:Cambria; |
---|
696 | mso-ascii-theme-font:major-latin; |
---|
697 | mso-fareast-font-family:"Times New Roman"; |
---|
698 | mso-fareast-theme-font:major-fareast; |
---|
699 | mso-hansi-font-family:Cambria; |
---|
700 | mso-hansi-theme-font:major-latin; |
---|
701 | mso-bidi-font-family:"Times New Roman"; |
---|
702 | mso-bidi-theme-font:major-bidi; |
---|
703 | color:#243F60; |
---|
704 | mso-themecolor:accent1; |
---|
705 | mso-themeshade:127;} |
---|
706 | span.HTMLPreformattedChar |
---|
707 | {mso-style-name:"HTML Preformatted Char"; |
---|
708 | mso-style-noshow:yes; |
---|
709 | mso-style-priority:99; |
---|
710 | mso-style-unhide:no; |
---|
711 | mso-style-locked:yes; |
---|
712 | mso-style-link:"HTML Preformatted"; |
---|
713 | font-family:"Courier New"; |
---|
714 | mso-ascii-font-family:"Courier New"; |
---|
715 | mso-hansi-font-family:"Courier New"; |
---|
716 | mso-bidi-font-family:"Courier New";} |
---|
717 | span.BalloonTextChar |
---|
718 | {mso-style-name:"Balloon Text Char"; |
---|
719 | mso-style-noshow:yes; |
---|
720 | mso-style-priority:99; |
---|
721 | mso-style-unhide:no; |
---|
722 | mso-style-locked:yes; |
---|
723 | mso-style-link:"Balloon Text"; |
---|
724 | mso-ansi-font-size:8.0pt; |
---|
725 | mso-bidi-font-size:8.0pt; |
---|
726 | font-family:"Tahoma","sans-serif"; |
---|
727 | mso-ascii-font-family:Tahoma; |
---|
728 | mso-fareast-font-family:"Times New Roman"; |
---|
729 | mso-fareast-theme-font:minor-fareast; |
---|
730 | mso-hansi-font-family:Tahoma; |
---|
731 | mso-bidi-font-family:Tahoma;} |
---|
732 | span.SpellE |
---|
733 | {mso-style-name:""; |
---|
734 | mso-spl-e:yes;} |
---|
735 | span.GramE |
---|
736 | {mso-style-name:""; |
---|
737 | mso-gram-e:yes;} |
---|
738 | .MsoChpDefault |
---|
739 | {mso-style-type:export-only; |
---|
740 | mso-default-props:yes; |
---|
741 | font-size:10.0pt; |
---|
742 | mso-ansi-font-size:10.0pt; |
---|
743 | mso-bidi-font-size:10.0pt;} |
---|
744 | @page WordSection1 |
---|
745 | {size:8.5in 11.0in; |
---|
746 | margin:1.0in 1.0in 1.0in 1.0in; |
---|
747 | mso-header-margin:.5in; |
---|
748 | mso-footer-margin:.5in; |
---|
749 | mso-paper-source:0;} |
---|
750 | div.WordSection1 |
---|
751 | {page:WordSection1;} |
---|
752 | /* List Definitions */ |
---|
753 | @list l0 |
---|
754 | {mso-list-id:203979460; |
---|
755 | mso-list-template-ids:88359672;} |
---|
756 | @list l0:level1 |
---|
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1053 | <style> |
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1054 | /* Style Definitions */ |
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1059 | mso-style-noshow:yes; |
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1069 | </style> |
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1070 | <![endif]--> |
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---|
1072 | <!--[if gte mso 9]><xml> |
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1104 | </v:shapetype><v:shape id="Picture_x0020_2" o:spid="_x0000_s1036" type="#_x0000_t75" |
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1105 | alt="GSAS-II logo" style='position:absolute;margin-left:56pt;margin-top:0; |
---|
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---|
1107 | mso-wrap-distance-left:0;mso-wrap-distance-top:0;mso-wrap-distance-right:0; |
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---|
1111 | <v:imagedata src="gsas2logo.png"/> |
---|
1112 | <w:wrap type="square" anchory="line"/> |
---|
1113 | </v:shape><![endif]--><![if !vml]><img width=128 height=128 src=gsas2logo.png |
---|
1114 | align=right alt="GSAS-II logo" v:shapes="Picture_x0020_2"><![endif]><span |
---|
1115 | style='mso-fareast-font-family:"Times New Roman"'>Help for GSAS-II<o:p></o:p></span></h1> |
---|
1116 | |
---|
1117 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1118 | is where to find help on various GSAS-II windows and plots. Note that GSAS-II |
---|
1119 | operates with three windows: the main <a href="#Data_tree">GSAS-II data tree</a> |
---|
1120 | window, which provides a hierarchical view of the current project; the <a |
---|
1121 | href="#Data_Frame">GSAS-II data editing</a> window, which shows the contents of |
---|
1122 | a particular section of the project, where values can be examined and changed; |
---|
1123 | and the <a href="#Plots">GSAS-II Plots</a> window, which shows graphical |
---|
1124 | representations of the results. <o:p></o:p></span></p> |
---|
1125 | |
---|
1126 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1127 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1128 | |
---|
1129 | <hr size=2 width="100%" align=center> |
---|
1130 | |
---|
1131 | </span></div> |
---|
1132 | |
---|
1133 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1134 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1135 | |
---|
1136 | <hr size=2 width="100%" align=center> |
---|
1137 | |
---|
1138 | </span></div> |
---|
1139 | |
---|
1140 | <h2><a name="Data_tree"><span style='mso-fareast-font-family:"Times New Roman"'>1. |
---|
1141 | GSAS-II data tree</span></a><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h2> |
---|
1142 | |
---|
1143 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1144 | is a hierarchical view of the data items in your GSAS-II project (name.gpx). |
---|
1145 | Clicking on any item in the window opens a view where information in that item |
---|
1146 | can be viewed or edited. For example, the <a href="#Sample_Parameters">"Sample |
---|
1147 | Parameters"</a> item contains information about how data were collected, |
---|
1148 | such as the sample temperature <a href="#Sample_Parameters">(see below)</a>. <o:p></o:p></span></p> |
---|
1149 | |
---|
1150 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
1151 | |
---|
1152 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
---|
1153 | menus associated with this window provide access to many features of GSAS-II, |
---|
1154 | as outlined below: <o:p></o:p></span></p> |
---|
1155 | |
---|
1156 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l4 level1 lfo2'><![if !supportLists]><span |
---|
1157 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
1158 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1159 | ‘<b style='mso-bidi-font-weight:normal'>File</b>’ –</p> |
---|
1160 | |
---|
1161 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1162 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1163 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1164 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1165 | style='mso-bidi-font-weight:normal'>Open project…</b> - Open a previously |
---|
1166 | saved GSAS-II project file (name.gpx). If you currently have a project file |
---|
1167 | open, you are asked if it is OK to over write it; Cancel will cancel the |
---|
1168 | process.</p> |
---|
1169 | |
---|
1170 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1171 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1172 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1173 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1174 | style='mso-bidi-font-weight:normal'>Save project</b> – Save the current |
---|
1175 | project. If a file name is shown after ‘Loaded <span class=GramE>Data:’<span |
---|
1176 | style='mso-fareast-font-family:"Times New Roman"'>,</span></span><span |
---|
1177 | style='mso-fareast-font-family:"Times New Roman"'> it will be saved there. |
---|
1178 | Otherwise, you will be prompted for a new name in a file dialog (you may change |
---|
1179 | directory as well). If the file exists, you will be asked if it OK to |
---|
1180 | overwrite.</span></p> |
---|
1181 | |
---|
1182 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1183 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1184 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1185 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1186 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Save |
---|
1187 | As…</span></b><span style='mso-fareast-font-family:"Times New Roman"'> - |
---|
1188 | Save the current project to a new file. A file dialog will be shown to enter |
---|
1189 | the name (and change directory if desired). If the file exists, you will be |
---|
1190 | asked if it OK to overwrite.</span></p> |
---|
1191 | |
---|
1192 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1193 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1194 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1195 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1196 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Close |
---|
1197 | project</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1198 | – Close the current project; you will be asked if you want to save it |
---|
1199 | first.</span></p> |
---|
1200 | |
---|
1201 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1202 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1203 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1204 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1205 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Exit</span></b><span |
---|
1206 | style='mso-fareast-font-family:"Times New Roman"'> – Exit the GSAS-II |
---|
1207 | program; if there is a current project you will be asked if you want to save it |
---|
1208 | first. Pressing the red X in the upper right (Windows) also exits (no save |
---|
1209 | option) GSAS-II; useful for escaping from GSAS-II if needed.</span></p> |
---|
1210 | |
---|
1211 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo2'><![if !supportLists]><span |
---|
1212 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
1213 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1214 | ‘<b style='mso-bidi-font-weight:normal'>Data</b>’ – </p> |
---|
1215 | |
---|
1216 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1217 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1218 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1219 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1220 | style='mso-bidi-font-weight:normal'>Read powder data…</b> - Read in |
---|
1221 | powder diffraction patterns (multiple patterns can be selected). GSAS-II can |
---|
1222 | read most of the old GSAS powder format files with the position in <span |
---|
1223 | class=SpellE>centidegrees</span> 2-theta. It can also read “<span |
---|
1224 | class=SpellE>xye</span>” format files used by <span class=SpellE>topas</span> |
---|
1225 | where the position is in degrees 2-theta. As each file is read, an old GSAS |
---|
1226 | style “instrument parameter file” is searched for; if not found a <span |
---|
1227 | class=SpellE>CuK</span><span style='font-family:Symbol'>a</span> laboratory |
---|
1228 | data set is assumed. </p> |
---|
1229 | |
---|
1230 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1231 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1232 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1233 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1234 | style='mso-bidi-font-weight:normal'>Read image data…</b> - Read in 2-D |
---|
1235 | powder diffraction images (multiple patterns can be selected). GSAS-II can read |
---|
1236 | many different image file formats including MAR345 files, Quantum ADSC files, |
---|
1237 | and tiff files from Perkin-Elmer, Pilatus, and GE. Although many of these |
---|
1238 | formats have data fields that should contain relevant information for the |
---|
1239 | exposure (e.g. wavelength), these are rarely filled in correctly by the data |
---|
1240 | acquisition software. Thus, you should have separately noted this information |
---|
1241 | as it will be needed</p> |
---|
1242 | |
---|
1243 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1244 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1245 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1246 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1247 | style='mso-bidi-font-weight:normal'>Read Powder Pattern Peaks…</b> - Read |
---|
1248 | in a list of powder pattern peak positions as either a d-spacing table or a set |
---|
1249 | of 2<span style='font-family:Symbol'>Q</span> positions; these can be used in |
---|
1250 | GSAS-II powder pattern indexing. </p> |
---|
1251 | |
---|
1252 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1253 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1254 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1255 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1256 | style='mso-bidi-font-weight:normal'>Read single crystal data…</b> - </p> |
---|
1257 | |
---|
1258 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1259 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1260 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1261 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1262 | style='mso-bidi-font-weight:normal'>Sum powder data</b> - </p> |
---|
1263 | |
---|
1264 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1265 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1266 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
1267 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1268 | style='mso-bidi-font-weight:normal'>Sum image data</b> - </p> |
---|
1269 | |
---|
1270 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1271 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1272 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
---|
1273 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1274 | style='mso-bidi-font-weight:normal'>Add phase</b> - </p> |
---|
1275 | |
---|
1276 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1277 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1278 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
---|
1279 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1280 | style='mso-bidi-font-weight:normal'>Delete phase</b> - </p> |
---|
1281 | |
---|
1282 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1283 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1284 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
---|
1285 | style='font:7.0pt "Times New Roman"'> |
---|
1286 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Rename |
---|
1287 | data</b> - </p> |
---|
1288 | |
---|
1289 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1290 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1291 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
---|
1292 | style='font:7.0pt "Times New Roman"'> |
---|
1293 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Delete |
---|
1294 | data</b> - </p> |
---|
1295 | |
---|
1296 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo2'><![if !supportLists]><span |
---|
1297 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
1298 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1299 | ‘<b style='mso-bidi-font-weight:normal'>Calculate</b>’ – </p> |
---|
1300 | |
---|
1301 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1302 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1303 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1304 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1305 | style='mso-bidi-font-weight:normal'>Make new PDFs</b> - </p> |
---|
1306 | |
---|
1307 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1308 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1309 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1310 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1311 | style='mso-bidi-font-weight:normal'>View LS <span class=SpellE>parms</span></b> |
---|
1312 | - </p> |
---|
1313 | |
---|
1314 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1315 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1316 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1317 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1318 | style='mso-bidi-font-weight:normal'>Refine</b> - </p> |
---|
1319 | |
---|
1320 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1321 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1322 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1323 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1324 | style='mso-bidi-font-weight:normal'>Sequential refine</b> - </p> |
---|
1325 | |
---|
1326 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1327 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1328 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1329 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1330 | style='mso-bidi-font-weight:normal'>Solve</b> - </p> |
---|
1331 | |
---|
1332 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo2'><![if !supportLists]><span |
---|
1333 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
1334 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1335 | ‘<b style='mso-bidi-font-weight:normal'>Import</b>’ – </p> |
---|
1336 | |
---|
1337 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1338 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1339 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1340 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1341 | style='mso-bidi-font-weight:normal'>Import GSAS Exp phase…</b> - </p> |
---|
1342 | |
---|
1343 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1344 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1345 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1346 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1347 | style='mso-bidi-font-weight:normal'>Import PDB phase…</b> - </p> |
---|
1348 | |
---|
1349 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1350 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1351 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1352 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1353 | style='mso-bidi-font-weight:normal'>Import CIF phase…</b> - </p> |
---|
1354 | |
---|
1355 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1356 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1357 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1358 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1359 | style='mso-bidi-font-weight:normal'>Import HKLs…</b> - </p> |
---|
1360 | |
---|
1361 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo2'><![if !supportLists]><span |
---|
1362 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
1363 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1364 | ‘<b style='mso-bidi-font-weight:normal'>Export</b>’ –</p> |
---|
1365 | |
---|
1366 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1367 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1368 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1369 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1370 | style='mso-bidi-font-weight:normal'>Export Powder Patterns…</b> - </p> |
---|
1371 | |
---|
1372 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1373 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1374 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1375 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1376 | style='mso-bidi-font-weight:normal'>Export All Peak Lists…</b> - </p> |
---|
1377 | |
---|
1378 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1379 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1380 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1381 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1382 | style='mso-bidi-font-weight:normal'>Export HKLs…</b> - </p> |
---|
1383 | |
---|
1384 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1385 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1386 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1387 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1388 | style='mso-bidi-font-weight:normal'>Export PDF…</b> - </p> |
---|
1389 | |
---|
1390 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1391 | auto;text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1392 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1393 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1394 | style='mso-bidi-font-weight:normal'>Export Phase…</b> - </p> |
---|
1395 | |
---|
1396 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
1397 | text-indent:-.25in;mso-list:l4 level2 lfo2'><![if !supportLists]><span |
---|
1398 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
1399 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1400 | style='mso-bidi-font-weight:normal'>Export CIF…</b> - </p> |
---|
1401 | |
---|
1402 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1403 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1404 | |
---|
1405 | <hr size=2 width="100%" align=center> |
---|
1406 | |
---|
1407 | </span></div> |
---|
1408 | |
---|
1409 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1410 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1411 | |
---|
1412 | <hr size=2 width="100%" align=center> |
---|
1413 | |
---|
1414 | </span></div> |
---|
1415 | |
---|
1416 | <h2><a name="Data_Frame"><span style='mso-fareast-font-family:"Times New Roman"'>2. |
---|
1417 | GSAS-II Data Editing Window</span></a><span style='mso-fareast-font-family: |
---|
1418 | "Times New Roman"'><o:p></o:p></span></h2> |
---|
1419 | |
---|
1420 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Different |
---|
1421 | information is displayed in the Data Editing Window, depending on which section |
---|
1422 | of the <a href="#Data_tree">data tree</a> is selected. For example, clicking on |
---|
1423 | the "Notebook" entry of the tree brings up the Notebook editing |
---|
1424 | window described below. <o:p></o:p></span></p> |
---|
1425 | |
---|
1426 | <h4><a name=Notebook><span style='mso-fareast-font-family:"Times New Roman"'>Notebook</span></a><span |
---|
1427 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
1428 | |
---|
1429 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1430 | window provides a place for you to enter whatever text commentary you wish. |
---|
1431 | Each time you enter this window, a date/time entry is provided for you. A |
---|
1432 | possibly useful technique is to select a portion of the console window after a |
---|
1433 | refinement completes (it will contain refinement results with residuals, new |
---|
1434 | values & <span class=SpellE>esds</span>) and paste it into this Notebook |
---|
1435 | window so it becomes a part of your project file.<o:p></o:p></span></p> |
---|
1436 | |
---|
1437 | <h4><a name=Controls><span style='mso-fareast-font-family:"Times New Roman"'>Controls</span></a><span |
---|
1438 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
1439 | |
---|
1440 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1441 | window provides the main controls for the major calculations in GSAS-II. At |
---|
1442 | present only Refinement Controls are presented. <o:p></o:p></span></p> |
---|
1443 | |
---|
1444 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Two |
---|
1445 | of the main refinement tools are the <span class=SpellE><span class=GramE>fortran</span></span> |
---|
1446 | MINPACK <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
---|
1447 | algorithms wrapped in python as provided in the <span class=SpellE>Scipy</span> |
---|
1448 | package and a third one is a python version utilizing only the <span |
---|
1449 | class=SpellE>numpy</span> package. The purpose is to </span>minimize the sum of |
---|
1450 | the squares of M<span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1451 | nonlinear functions in N variables by a modification of the <span class=SpellE>Levenberg</span>-Marquardt |
---|
1452 | algorithm. The <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
---|
1453 | routines were written by </span>Burton S. <span class=SpellE>Garbow</span>, |
---|
1454 | Kenneth E. <span class=SpellE>Hillstrom</span>, <span class=GramE>Jorge</span> |
---|
1455 | J. <span class=GramE>More (Argonne National Laboratory, 1980).</span> The |
---|
1456 | python/numpy version was developed by us based on the material in Numerical |
---|
1457 | Recipes (Press, Flannery, <span class=SpellE><span class=GramE>Teulosky</span></span> |
---|
1458 | & <span class=SpellE>Vetterling</span>) for the <span class=SpellE>Levenberg</span>-Marquardt |
---|
1459 | algorithm.<span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></p> |
---|
1460 | |
---|
1461 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
1462 | |
---|
1463 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l5 level1 lfo4'><![if !supportLists]><span |
---|
1464 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
1465 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1466 | style='mso-fareast-font-family:"Times New Roman"'>Select whether the refinement |
---|
1467 | uses ‘analytic <span class=SpellE>Jacobian</span>’, ‘analytic |
---|
1468 | Hessian’ or ‘numeric’ derivatives. The latter is slower and |
---|
1469 | perhaps a bit less accurate, but may be needed if the analytic functions are |
---|
1470 | not fully developed. The <span class=SpellE>Jacobian</span> matrix is shaped N x |
---|
1471 | M (parameters x observations) and is much larger than the Hessian matrix which |
---|
1472 | is shaped M x M (parameters x parameters). Generally use ‘analytic |
---|
1473 | Hessian’ for routine work.<o:p></o:p></span></p> |
---|
1474 | |
---|
1475 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo4'><![if !supportLists]><span |
---|
1476 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
1477 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1478 | style='mso-fareast-font-family:"Times New Roman"'>Select ‘Min |
---|
1479 | delta-M/M’ for convergence; the refinement will stop when the change in |
---|
1480 | the minimization function is less than this value. Set Min delta-M/M = 1.0 to |
---|
1481 | force just a single cycle to be performed. A value less than 10<sup>-4</sup> |
---|
1482 | (the default) generally gives no better result. The allowed range is 10<sup>-9</sup> |
---|
1483 | to 1.0.<o:p></o:p></span></p> |
---|
1484 | |
---|
1485 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo4'><![if !supportLists]><span |
---|
1486 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
1487 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1488 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic Jacobean’ |
---|
1489 | is chosen then select ‘Initial shift factor’ for the first cycle of |
---|
1490 | refinement. This value is modified by the least squares routine. The allowed |
---|
1491 | range is 10<sup>-5</sup> to 100. Smaller values may be needed if your initial <span |
---|
1492 | class=GramE>refinement</span> trials immediately diverge, however make sure |
---|
1493 | your starting parameter values are ‘reasonable’. The selected |
---|
1494 | default (=1.0) normally gives good performance.<o:p></o:p></span></p> |
---|
1495 | |
---|
1496 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo4'><![if !supportLists]><span |
---|
1497 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
1498 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1499 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic Hessian’ |
---|
1500 | is chosen then select ‘Max cycles’, the maximum number of least |
---|
1501 | squares cycles to be performed. Choices are given in the pull down selection; |
---|
1502 | the default is 3 cycles.<o:p></o:p></span></p> |
---|
1503 | |
---|
1504 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l5 level1 lfo4'><![if !supportLists]><span |
---|
1505 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
1506 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1507 | style='mso-fareast-font-family:"Times New Roman"'>Select data for sequential |
---|
1508 | refinement; the data sets may be done in ‘reverse order’. <o:p></o:p></span></p> |
---|
1509 | |
---|
1510 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Covariance<o:p></o:p></span></h4> |
---|
1511 | |
---|
1512 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1513 | window is blank; the GSASII Plots window ‘<a href="#Covariance">Covariance’</a> |
---|
1514 | shows a graphical representation of the variance-covariance matrix <o:p></o:p></span></p> |
---|
1515 | |
---|
1516 | <h4><a name=Constraints><span style='mso-fareast-font-family:"Times New Roman"'>Constraints<o:p></o:p></span></a></h4> |
---|
1517 | |
---|
1518 | <span style='mso-bookmark:Constraints'></span> |
---|
1519 | |
---|
1520 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1521 | window shows the constraints to be used in a refinement. It is organized into |
---|
1522 | three tabbed pages. ‘Phase constraints’ contain those involving |
---|
1523 | parameters that describe aspects of the crystalline phases to be used in the |
---|
1524 | refinement (e.g. atom coordinates, thermal motion and site fraction |
---|
1525 | parameters). ‘Histogram/Phase constraints’ are those which describe |
---|
1526 | aspects of the pattern that depend on both the phase and the data set used in |
---|
1527 | the refinement (e.g. </span><span style='font-family:Symbol;mso-fareast-font-family: |
---|
1528 | "Times New Roman"'>m</span><span style='mso-fareast-font-family:"Times New Roman"'>strain |
---|
1529 | and crystallite size parameters). ‘Histogram constraints’ are those |
---|
1530 | that depend only on the data set (e.g. profile coefficients U<span class=GramE>,V,W,X</span> |
---|
1531 | and Y).<o:p></o:p></span></p> |
---|
1532 | |
---|
1533 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
1534 | |
---|
1535 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l6 level1 lfo6'><![if !supportLists]><span |
---|
1536 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
1537 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1538 | style='mso-fareast-font-family:"Times New Roman"'>Select the tab for the |
---|
1539 | parameter types you wish to constrain. Each will have the same possibilities in |
---|
1540 | the ‘Edit menu.<o:p></o:p></span></p> |
---|
1541 | |
---|
1542 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l6 level1 lfo6'><![if !supportLists]><span |
---|
1543 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
1544 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1545 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
1546 | style='mso-bidi-font-weight:normal'>Edit</b>’ – <o:p></o:p></span></p> |
---|
1547 | |
---|
1548 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1549 | auto;text-indent:-.25in;mso-list:l6 level2 lfo6'><![if !supportLists]><span |
---|
1550 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1551 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1552 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
1553 | "Times New Roman"'>Add</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
1554 | style='mso-fareast-font-family:"Times New Roman"'> Hold</span></b><span |
---|
1555 | style='mso-fareast-font-family:"Times New Roman"'> – select a parameter |
---|
1556 | that you wish to remain fixed although other parameters of the same type may be |
---|
1557 | selected as a group for refinement. For example, if the space group for a phase |
---|
1558 | has a polar axis (e.g. the b-axis in P2<sub>1</sub>), then one atom y-parameter |
---|
1559 | is arbitrary and should be selected for a Hold to keep the structure from |
---|
1560 | drifting up or down the y-axis during refinement. If selected, a dialog box |
---|
1561 | will appear showing the list of available parameters; select one and then OK to |
---|
1562 | implement it, Cancel will cancel the operation. The held parameter will be |
---|
1563 | shown in the constraint window with the keyword ‘FIXED’. A Delete |
---|
1564 | button can be used to remove it.<o:p></o:p></span></p> |
---|
1565 | |
---|
1566 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1567 | auto;text-indent:-.25in;mso-list:l6 level2 lfo6'><![if !supportLists]><span |
---|
1568 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1569 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1570 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
1571 | equivalence</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1572 | – select a list of parameters that should have the same value (possibly |
---|
1573 | with a non-unitary multiplier for some). Examples are a list of atoms with the |
---|
1574 | same thermal motion <span class=SpellE>Uiso</span>, sets of profile |
---|
1575 | coefficients U<span class=GramE>,V,W</span> across multiple data sets. If |
---|
1576 | selected, a dialog box will appear with a list of the available parameters. |
---|
1577 | Select one and press OK; a second dialog box will appear with only those |
---|
1578 | parameters that can be made equivalent to the first one. Choose those and press |
---|
1579 | OK. Cancel in either dialog will cancel the operation. The equivalenced |
---|
1580 | 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; |
---|
1581 | usually M1=1.0 and M2=-1.0, but can be changed via the ‘Edit’ |
---|
1582 | button. The keyword ‘EQUIV’ marks it as <span class=GramE>an |
---|
1583 | equivalence</span>. A Delete button can be used to remove it.<o:p></o:p></span></p> |
---|
1584 | |
---|
1585 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1586 | auto;text-indent:-.25in;mso-list:l6 level2 lfo6'><![if !supportLists]><span |
---|
1587 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1588 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1589 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
1590 | constraint</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1591 | – select a list of parameters whose sum (with possible non-unitary |
---|
1592 | multipliers) is fixed. For example, the sum of site fractions for atoms on the |
---|
1593 | same site could be fixed to unity. If selected, a dialog box will appear with a |
---|
1594 | list of the available parameters. Select one and press OK; a second dialog box |
---|
1595 | will appear with only those parameters that can be used in a constraint with |
---|
1596 | the first one. Choose those and press OK. Cancel in either dialog will cancel |
---|
1597 | the operation. The equivalenced parameters will show as an equation of the form |
---|
1598 | M<sub>1</sub>*P<sub>1</sub>+M<sub>2</sub>*P<sub>2</sub>+…=C; the multipliers |
---|
1599 | M1, <span class=GramE>M2, …</span> and C can be changed via the |
---|
1600 | ‘Edit’ button. The keyword ‘CONSTR’ marks it as a |
---|
1601 | constraint. A Delete button can be used to remove it.<o:p></o:p></span></p> |
---|
1602 | |
---|
1603 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
1604 | text-indent:-.25in;mso-list:l6 level2 lfo6'><![if !supportLists]><span |
---|
1605 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1606 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1607 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
1608 | function</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1609 | – this is very similar the “Add constraint” type except that |
---|
1610 | the result of the sum can be varied in the refinement. The keyword |
---|
1611 | ‘FUNCT’ marks it as a function; the ‘Refine?’ box |
---|
1612 | indicates your choice to refine the result of the sum. A Delete button can be |
---|
1613 | used to remove it.<o:p></o:p></span></p> |
---|
1614 | |
---|
1615 | <h4><a name=Restraints><span style='mso-fareast-font-family:"Times New Roman"'>Restraints</span></a><span |
---|
1616 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
1617 | |
---|
1618 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1619 | window... <o:p></o:p></span></p> |
---|
1620 | |
---|
1621 | <h4><a name=Limits><span style='mso-fareast-font-family:"Times New Roman"'>Limits</span></a><span |
---|
1622 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
1623 | |
---|
1624 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1625 | window shows the limits in position to be used in any fitting for this powder |
---|
1626 | pattern. The ‘original’ values are obtained from the minimum & |
---|
1627 | maximum values in the powder pattern. You can modify ‘changed’ as |
---|
1628 | needed.<o:p></o:p></span></p> |
---|
1629 | |
---|
1630 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
1631 | |
---|
1632 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l1 level1 lfo8'><![if !supportLists]><span |
---|
1633 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
1634 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1635 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
1636 | style='mso-bidi-font-weight:normal'>File</b>’ – <b |
---|
1637 | style='mso-bidi-font-weight:normal'>Copy</b> - this copies the limits shown to |
---|
1638 | other selected powder patterns. If used, a dialog box (Copy Limits) will appear |
---|
1639 | showing the list of available powder patterns, you can copy the limits to any |
---|
1640 | or all of them; select ‘All’ to copy them to all patterns. Then |
---|
1641 | select ‘OK’ to do the copy; ‘Cancel’ to cancel the |
---|
1642 | operation.<o:p></o:p></span></p> |
---|
1643 | |
---|
1644 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l1 level1 lfo8'><![if !supportLists]><span |
---|
1645 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
1646 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
1647 | style='mso-fareast-font-family:"Times New Roman"'>You can change <span |
---|
1648 | class=SpellE>Tmin</span> and <span class=SpellE>Tmax</span> in the |
---|
1649 | ‘changed’ row as needed. Use the mouse to select the value to be |
---|
1650 | changed (the background on the box will be blue or have a black border or a |
---|
1651 | vertical bar will appear in the value), then enter the new value and press |
---|
1652 | Enter or click the mouse elsewhere in the Background window. This will set the |
---|
1653 | new value.<o:p></o:p></span></p> |
---|
1654 | |
---|
1655 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Texture Control |
---|
1656 | Window<o:p></o:p></span></h4> |
---|
1657 | |
---|
1658 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1659 | window... <o:p></o:p></span></p> |
---|
1660 | |
---|
1661 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Image Masks<o:p></o:p></span></h4> |
---|
1662 | |
---|
1663 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1664 | window... <o:p></o:p></span></p> |
---|
1665 | |
---|
1666 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Atoms Control |
---|
1667 | Window<o:p></o:p></span></h4> |
---|
1668 | |
---|
1669 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1670 | window... <o:p></o:p></span></p> |
---|
1671 | |
---|
1672 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>Diffraction Data |
---|
1673 | Control Window<o:p></o:p></span></h3> |
---|
1674 | |
---|
1675 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1676 | window... <o:p></o:p></span></p> |
---|
1677 | |
---|
1678 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>Draw Atoms Control |
---|
1679 | Window<o:p></o:p></span></h3> |
---|
1680 | |
---|
1681 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1682 | window... <o:p></o:p></span></p> |
---|
1683 | |
---|
1684 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>Pawley Control |
---|
1685 | Window<o:p></o:p></span></h3> |
---|
1686 | |
---|
1687 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1688 | window... <o:p></o:p></span></p> |
---|
1689 | |
---|
1690 | <h3><a name=Images><span style='mso-fareast-font-family:"Times New Roman"'>Images |
---|
1691 | Control<o:p></o:p></span></a></h3> |
---|
1692 | |
---|
1693 | <span style='mso-bookmark:Images'></span> |
---|
1694 | |
---|
1695 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1696 | window... <o:p></o:p></span></p> |
---|
1697 | |
---|
1698 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>PDF Controls |
---|
1699 | Control Window<o:p></o:p></span></h3> |
---|
1700 | |
---|
1701 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1702 | window... <o:p></o:p></span></p> |
---|
1703 | |
---|
1704 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
1705 | |
---|
1706 | <h3>Phase Windows</h3> |
---|
1707 | |
---|
1708 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>When |
---|
1709 | a phase is selected from the <a href="#Data_tree">data tree</a>, parameters are |
---|
1710 | show from that selected phase in a tabbed window. Clicking on the tab raises |
---|
1711 | the windows listed below. <o:p></o:p></span></p> |
---|
1712 | |
---|
1713 | <h4><a name=General><u>General</u> Phase Parameters</a></h4> |
---|
1714 | |
---|
1715 | <span style='mso-bookmark:General'></span> |
---|
1716 | |
---|
1717 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1718 | is used for overall parameters describing the phase such as the space group, |
---|
1719 | the unit cell parameters and overall parameters for the atom present in the |
---|
1720 | phase. <a name=Data><o:p></o:p></a></span></p> |
---|
1721 | |
---|
1722 | <h4><span style='mso-bookmark:Data'>Sample <u>Data</u></span></h4> |
---|
1723 | |
---|
1724 | <span style='mso-bookmark:Data'></span> |
---|
1725 | |
---|
1726 | <h4><a name=Texture><u>Texture</u> Parameters</a></h4> |
---|
1727 | |
---|
1728 | <h4><span style='mso-bookmark:Texture'><a name=Atoms><u>Atom</u> Parameter<u>s</u></a></span></h4> |
---|
1729 | |
---|
1730 | <span style='mso-bookmark:Atoms'></span> |
---|
1731 | |
---|
1732 | <h4><span style='mso-bookmark:Texture'><a name="Draw_Options"><u>Draw Options</u></a></span></h4> |
---|
1733 | |
---|
1734 | <span style='mso-bookmark:Draw_Options'></span> |
---|
1735 | |
---|
1736 | <h4><span style='mso-bookmark:Texture'><a name="Draw_Atoms"><u>Draw Atoms</u></a></span></h4> |
---|
1737 | |
---|
1738 | <span style='mso-bookmark:Draw_Atoms'></span> |
---|
1739 | |
---|
1740 | <h3><span style='mso-bookmark:Texture'>Powder Histogram Windows</span></h3> |
---|
1741 | |
---|
1742 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1743 | "Times New Roman"'>When a powder diffraction data set (histogram) is selected |
---|
1744 | from the </span></span><a href="#Data_tree"><span style='mso-bookmark:Texture'><span |
---|
1745 | style='mso-fareast-font-family:"Times New Roman"'>data tree</span></span><span |
---|
1746 | style='mso-bookmark:Texture'></span></a><span style='mso-bookmark:Texture'><span |
---|
1747 | style='mso-fareast-font-family:"Times New Roman"'>, a variety of subcategories |
---|
1748 | in the tree are shown. The items that are shown depend on the data set type. |
---|
1749 | Selecting a subcategory raises the window listed below. <o:p></o:p></span></span></p> |
---|
1750 | |
---|
1751 | <h4><span style='mso-bookmark:Texture'><a name=Comments></a><a name=""></a><span |
---|
1752 | style='mso-bookmark:Comments'><u>Comments</u></span></span></h4> |
---|
1753 | |
---|
1754 | <span style='mso-bookmark:Comments'></span> |
---|
1755 | |
---|
1756 | <h4><span style='mso-bookmark:Texture'><a name=Background><span |
---|
1757 | style='mso-fareast-font-family:"Times New Roman"'>Background</span></a></span><span |
---|
1758 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1759 | |
---|
1760 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1761 | "Times New Roman"'>This window shows the choice of background function and |
---|
1762 | coefficients to be used in fitting this powder pattern.<o:p></o:p></span></span></p> |
---|
1763 | |
---|
1764 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1765 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
1766 | |
---|
1767 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l7 level1 lfo10'><span |
---|
1768 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1769 | "Times New Roman"'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
---|
1770 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>Menu |
---|
1771 | ‘<b style='mso-bidi-font-weight:normal'>File</b>’ – <b |
---|
1772 | style='mso-bidi-font-weight:normal'>Copy</b> – this copies the background |
---|
1773 | parameters shown to other selected powder patterns. If used, a dialog box (Copy |
---|
1774 | Parameters) will appear showing the list of available powder patterns, you can |
---|
1775 | copy the background parameters to any or all of them; select ‘All’ |
---|
1776 | to copy them to all patterns. Then select ‘OK’ to do the copy; |
---|
1777 | ‘Cancel’ to cancel the operation.<o:p></o:p></span></span></p> |
---|
1778 | |
---|
1779 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l7 level1 lfo10'><span |
---|
1780 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1781 | "Times New Roman"'><span style='mso-list:Ignore'>2.<span style='font:7.0pt "Times New Roman"'> |
---|
1782 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
1783 | can select a different Background function from the pull down tab.<o:p></o:p></span></span></p> |
---|
1784 | |
---|
1785 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l7 level1 lfo10'><span |
---|
1786 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1787 | "Times New Roman"'><span style='mso-list:Ignore'>3.<span style='font:7.0pt "Times New Roman"'> |
---|
1788 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
1789 | can choose to refine/not refine the background coefficients.<o:p></o:p></span></span></p> |
---|
1790 | |
---|
1791 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l7 level1 lfo10'><span |
---|
1792 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1793 | "Times New Roman"'><span style='mso-list:Ignore'>4.<span style='font:7.0pt "Times New Roman"'> |
---|
1794 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
1795 | can select the number of background coefficients to be used (1-36).<o:p></o:p></span></span></p> |
---|
1796 | |
---|
1797 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l7 level1 lfo10'><span |
---|
1798 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1799 | "Times New Roman"'><span style='mso-list:Ignore'>5.<span style='font:7.0pt "Times New Roman"'> |
---|
1800 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
1801 | can change individual background coefficient values. Enter the value then press |
---|
1802 | Enter or click the mouse elsewhere in the Background window. This will set the |
---|
1803 | new value.<o:p></o:p></span></span></p> |
---|
1804 | |
---|
1805 | <h4><span style='mso-bookmark:Texture'><a name="Instrument_Parameters"><span |
---|
1806 | style='mso-fareast-font-family:"Times New Roman"'>Instrument Parameters</span></a></span><span |
---|
1807 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1808 | |
---|
1809 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1810 | "Times New Roman"'>This window... <o:p></o:p></span></span></p> |
---|
1811 | |
---|
1812 | <h4><span style='mso-bookmark:Texture'><a name="Sample_Parameters"><span |
---|
1813 | style='mso-fareast-font-family:"Times New Roman"'>Sample Parameters</span></a></span><span |
---|
1814 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1815 | |
---|
1816 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1817 | "Times New Roman"'>This window... <o:p></o:p></span></span></p> |
---|
1818 | |
---|
1819 | <h4><span style='mso-bookmark:Texture'><a name="Peak_List"></a><a |
---|
1820 | name="Powder_Peaks"><span style='mso-bookmark:Peak_List'><span |
---|
1821 | style='mso-fareast-font-family:"Times New Roman"'>Peak List</span></span></a></span><span |
---|
1822 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1823 | |
---|
1824 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1825 | "Times New Roman"'>This window shows the list of peaks that will be used by the |
---|
1826 | peak fitting refinement. It is filled by picking peaks in the powder pattern |
---|
1827 | displayed in the GSASII Plots window as a sequence of ‘+’ marks. |
---|
1828 | See </span></span><a href="#Powder_Patterns"><span style='mso-bookmark:Texture'><span |
---|
1829 | style='mso-fareast-font-family:"Times New Roman"'>Powder Patterns</span></span><span |
---|
1830 | style='mso-bookmark:Texture'></span></a><span style='mso-bookmark:Texture'><span |
---|
1831 | style='mso-fareast-font-family:"Times New Roman"'> below for details for what |
---|
1832 | can be done on this plot.<o:p></o:p></span></span></p> |
---|
1833 | |
---|
1834 | <h4><span style='mso-bookmark:Texture'><a name="Index_Peaks"><span |
---|
1835 | style='mso-fareast-font-family:"Times New Roman"'>Index Peak List</span></a></span><span |
---|
1836 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1837 | |
---|
1838 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1839 | "Times New Roman"'>This window shows the list of peaks that will be used for |
---|
1840 | indexing (see </span></span><a href="#Unit_Cells_List"><span style='mso-bookmark: |
---|
1841 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Unit Cells |
---|
1842 | List</span></span><span style='mso-bookmark:Texture'></span></a><span |
---|
1843 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'>). |
---|
1844 | It must be filled before indexing can proceed. When indexing is completed, this |
---|
1845 | display will show the resulting <span class=SpellE>hkl</span> values for every |
---|
1846 | indexed reflection along with the calculated d-spacing (‘d-<span |
---|
1847 | class=SpellE>calc</span>’) for the selected unit cell in </span></span><a |
---|
1848 | href="#Unit_Cells_List"><span style='mso-bookmark:Texture'><span |
---|
1849 | style='mso-fareast-font-family:"Times New Roman"'>Unit Cells List</span></span><span |
---|
1850 | style='mso-bookmark:Texture'></span></a><span style='mso-bookmark:Texture'><span |
---|
1851 | style='mso-fareast-font-family:"Times New Roman"'>.<o:p></o:p></span></span></p> |
---|
1852 | |
---|
1853 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1854 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
1855 | |
---|
1856 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l3 level1 lfo12'><span |
---|
1857 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1858 | "Times New Roman"'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
---|
1859 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>Menu |
---|
1860 | ‘<b style='mso-bidi-font-weight:normal'>Operations</b>’ – <b |
---|
1861 | style='mso-bidi-font-weight:normal'>Load/Reload</b> – loads the peak |
---|
1862 | positions & intensities from the </span></span><a href="#Peak_List"><span |
---|
1863 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Peak |
---|
1864 | List</span></span><span style='mso-bookmark:Texture'></span></a><span |
---|
1865 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1866 | to make them available for the indexing routine. The d-<span class=SpellE>obs</span> |
---|
1867 | is obtained from Bragg’s Law after applying the Zero correction shown on |
---|
1868 | the </span></span><a href="#Instrument_Parameters"><span style='mso-bookmark: |
---|
1869 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Instrument |
---|
1870 | Parameters</span></span><span style='mso-bookmark:Texture'></span></a><span |
---|
1871 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1872 | table to the position shown here.<o:p></o:p></span></span></p> |
---|
1873 | |
---|
1874 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l3 level1 lfo12'><span |
---|
1875 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
1876 | "Times New Roman"'><span style='mso-list:Ignore'>2.<span style='font:7.0pt "Times New Roman"'> |
---|
1877 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
1878 | may deselect individual peaks from indexing by <span class=SpellE>unchecking</span> |
---|
1879 | the corresponding ‘use’ box.<o:p></o:p></span></span></p> |
---|
1880 | |
---|
1881 | <h4><span style='mso-bookmark:Texture'><a name="Cell_Indexing_Refine"><span |
---|
1882 | style='mso-fareast-font-family:"Times New Roman"'>Unit Cells List</span></a></span><span |
---|
1883 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1884 | |
---|
1885 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1886 | "Times New Roman"'>This window... <o:p></o:p></span></span></p> |
---|
1887 | |
---|
1888 | <h4><span style='mso-bookmark:Texture'><a name="Reflection_List"><span |
---|
1889 | style='mso-fareast-font-family:"Times New Roman"'>Reflection List</span></a></span><span |
---|
1890 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
---|
1891 | |
---|
1892 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1893 | "Times New Roman"'>This window... <o:p></o:p></span></span></p> |
---|
1894 | |
---|
1895 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1896 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1897 | |
---|
1898 | <hr size=2 width="100%" align=center> |
---|
1899 | |
---|
1900 | </span></span></div> |
---|
1901 | |
---|
1902 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1903 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1904 | |
---|
1905 | <hr size=2 width="100%" align=center> |
---|
1906 | |
---|
1907 | </span></span></div> |
---|
1908 | |
---|
1909 | <h2><span style='mso-bookmark:Texture'><a name=Plots><span style='mso-fareast-font-family: |
---|
1910 | "Times New Roman"'>3. GSAS-II Plots Window</span></a></span><span |
---|
1911 | style='mso-bookmark:Plots'></span><span style='mso-bookmark:Texture'><span |
---|
1912 | style='mso-fareast-font-family:"Times New Roman";font-weight:normal'> </span></span><span |
---|
1913 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h2> |
---|
1914 | |
---|
1915 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1916 | "Times New Roman"'>This window presents all the graphical material as a |
---|
1917 | multipage tabbed set of plots utilizing the <span class=SpellE>matplotlib</span> |
---|
1918 | python package. Each page has a tool bar (at bottom in Windows) with the |
---|
1919 | controls<o:p></o:p></span></span></p> |
---|
1920 | |
---|
1921 | <p class=MsoNormal><span style='mso-bookmark:Texture'></span><span |
---|
1922 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
1923 | mso-no-proof:yes'><img border=0 width=225 height=31 id="_x0000_i1032" |
---|
1924 | src=graphbar.jpg></span></span><span style='mso-bookmark:Texture'><span |
---|
1925 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></p> |
---|
1926 | |
---|
1927 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1928 | "Times New Roman"'>These are Home, Back, Forward, Pan, Zoom, Save and Help, |
---|
1929 | respectively. <o:p></o:p></span></span></p> |
---|
1930 | |
---|
1931 | <ul type=disc> |
---|
1932 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1933 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1934 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Home: |
---|
1935 | returns the plot to the initial scaling <o:p></o:p></span></span></li> |
---|
1936 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1937 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1938 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Back: |
---|
1939 | returns the plot to the previous scaling <o:p></o:p></span></span></li> |
---|
1940 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1941 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1942 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Forward: |
---|
1943 | reverses the action in the previous press(es) of the Back button <o:p></o:p></span></span></li> |
---|
1944 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1945 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1946 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Pan: |
---|
1947 | allows you to control panning across the plot (press left mouse button) |
---|
1948 | and zooming (press right mouse button), <o:p></o:p></span></span></li> |
---|
1949 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1950 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1951 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Zoom: |
---|
1952 | allows you to select a portion of the plot (press right mouse button & |
---|
1953 | drag for zoom box) for the next plot. <o:p></o:p></span></span></li> |
---|
1954 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1955 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1956 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Save: |
---|
1957 | allows you to save the currently displayed plot in one of several |
---|
1958 | graphical formats suitable for printing or insertion in a document. The <o:p></o:p></span></span></li> |
---|
1959 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
1960 | mso-list:l0 level1 lfo13;tab-stops:list .5in'><span style='mso-bookmark: |
---|
1961 | Texture'><span style='mso-fareast-font-family:"Times New Roman"'>Help: |
---|
1962 | accesses GSASII help on the specific plot type. <o:p></o:p></span></span></li> |
---|
1963 | </ul> |
---|
1964 | |
---|
1965 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1966 | "Times New Roman"'><o:p> </o:p></span></span></p> |
---|
1967 | |
---|
1968 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1969 | "Times New Roman"'>Below the toolbar may be a status bar that on the left may |
---|
1970 | show either an instruction for a keyed input or a pull down selection of keyed |
---|
1971 | input; on the right may be displayed position dependent information that is |
---|
1972 | updated as the mouse is moved over the plot region.<o:p></o:p></span></span></p> |
---|
1973 | |
---|
1974 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1975 | "Times New Roman"'><o:p> </o:p></span></span></p> |
---|
1976 | |
---|
1977 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1978 | "Times New Roman"'>The specific types of plots that are pages in the GSASII |
---|
1979 | Plots windows are next.<o:p></o:p></span></span></p> |
---|
1980 | |
---|
1981 | <h4><span style='mso-bookmark:Texture'><a name="Powder_Patterns"><span |
---|
1982 | style='mso-fareast-font-family:"Times New Roman"'>Powder Patterns</span></a></span><span |
---|
1983 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
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1984 | |
---|
1985 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1986 | "Times New Roman"'>The powder patterns that are part of your project are shown |
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1987 | on this page. They can be displayed as a stack of powder patterns, just a |
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1988 | single pattern or as a contour image of the peak intensities. What can be done |
---|
1989 | here will depend on which is displayed and on which item in the GSAS-II data |
---|
1990 | tree you have selected.<o:p></o:p></span></span></p> |
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1991 | |
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1992 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
1993 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
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1994 | |
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1995 | <h4><span style='mso-bookmark:Texture'><a name=Covariance><span |
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1996 | style='mso-fareast-font-family:"Times New Roman"'>Covariance</span></a></span><span |
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1997 | style='mso-bookmark:Texture'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></h4> |
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1998 | |
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1999 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
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2000 | "Times New Roman"'>The variance-covariance matrix as a color coded array is |
---|
2001 | shown on this page. The color bar to the right shows the range of <span |
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2002 | class=SpellE>covariances</span> (-1 to 1) and corresponding colors. The |
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2003 | parameter names are to the right and the parameter numbers are below the plot.<o:p></o:p></span></span></p> |
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2004 | |
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2005 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2006 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
2007 | |
---|
2008 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l2 level1 lfo15'><span |
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2009 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2010 | "Times New Roman"'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
---|
2011 | </span></span></span><![endif]>Move the mouse cursor across the plot. If on a |
---|
2012 | diagonal cell, the parameter name, value and <span class=SpellE>esd</span> is |
---|
2013 | shown both as a tool tip and in the right hand portion of the status bar. If |
---|
2014 | the cursor is off the diagonal, the two parameter names and their covariance |
---|
2015 | are shown in the tool tip and the status bar.</span></p> |
---|
2016 | |
---|
2017 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l2 level1 lfo15'><span |
---|
2018 | style='mso-bookmark:Texture'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2019 | "Times New Roman"'><span style='mso-list:Ignore'>2.<span style='font:7.0pt "Times New Roman"'> |
---|
2020 | </span></span></span><![endif]><span class=GramE>Type ‘s’</span> |
---|
2021 | – A color scheme selection dialog is shown. Select a color scheme and |
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2022 | press <span class=GramE>OK,</span> the new color scheme will be plotted. The |
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2023 | default is ‘<span class=SpellE>RdYlGn</span>’.</span></p> |
---|
2024 | |
---|
2025 | <h4><span style='mso-bookmark:Texture'><a name="Structure_Factors"><span |
---|
2026 | style='mso-fareast-font-family:"Times New Roman"'>Structure Factors </span></a></span></h4> |
---|
2027 | |
---|
2028 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2029 | "Times New Roman"'>This plot shows... <o:p></o:p></span></span></p> |
---|
2030 | |
---|
2031 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2032 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
2033 | |
---|
2034 | <h4><span style='mso-bookmark:Texture'><a name="Powder_Lines"><span |
---|
2035 | style='mso-fareast-font-family:"Times New Roman"'>Powder Lines </span></a></span></h4> |
---|
2036 | |
---|
2037 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2038 | "Times New Roman"'>This plot shows... <o:p></o:p></span></span></p> |
---|
2039 | |
---|
2040 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2041 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
2042 | |
---|
2043 | <h4><span style='mso-bookmark:Texture'><a name="Peak_Widths"><span |
---|
2044 | style='mso-fareast-font-family:"Times New Roman"'>Peak Widths </span></a></span></h4> |
---|
2045 | |
---|
2046 | <p class=MsoNormal><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2047 | "Times New Roman"'>This plot shows... <o:p></o:p></span></span></p> |
---|
2048 | |
---|
2049 | <h5><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2050 | "Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
2051 | |
---|
2052 | <h4><span style='mso-bookmark:Texture'><span style='mso-fareast-font-family: |
---|
2053 | "Times New Roman"'>Texture </span></span></h4> |
---|
2054 | |
---|
2055 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2056 | plot shows... <o:p></o:p></span></p> |
---|
2057 | |
---|
2058 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2059 | |
---|
2060 | <h4><a name="Sequential_refinement"><span style='mso-fareast-font-family:"Times New Roman"'>Sequential |
---|
2061 | refinement </span></a></h4> |
---|
2062 | |
---|
2063 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2064 | plot shows... <o:p></o:p></span></p> |
---|
2065 | |
---|
2066 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2067 | |
---|
2068 | <h4><a name="2D_Powder_Image"><span style='mso-fareast-font-family:"Times New Roman"'>2D |
---|
2069 | Powder Image </span></a></h4> |
---|
2070 | |
---|
2071 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2072 | plot shows... <o:p></o:p></span></p> |
---|
2073 | |
---|
2074 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2075 | |
---|
2076 | <h4><a name="2D_Integration"><span style='mso-fareast-font-family:"Times New Roman"'>2D |
---|
2077 | Integration </span></a></h4> |
---|
2078 | |
---|
2079 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2080 | plot shows... <o:p></o:p></span></p> |
---|
2081 | |
---|
2082 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2083 | |
---|
2084 | <h4><a name="2D_Transformed_Powder_Image"><span style='mso-fareast-font-family: |
---|
2085 | "Times New Roman"'>2D Transformed Powder Image </span></a></h4> |
---|
2086 | |
---|
2087 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2088 | plot shows... <o:p></o:p></span></p> |
---|
2089 | |
---|
2090 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2091 | |
---|
2092 | <h4><a name=Mustrain><span style='mso-fareast-font-family:"Times New Roman"'>Mustrain |
---|
2093 | </span></a></h4> |
---|
2094 | |
---|
2095 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2096 | plot shows... <o:p></o:p></span></p> |
---|
2097 | |
---|
2098 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2099 | |
---|
2100 | <h4><a name=Size><span style='mso-fareast-font-family:"Times New Roman"'>Size </span></a></h4> |
---|
2101 | |
---|
2102 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2103 | plot shows... <o:p></o:p></span></p> |
---|
2104 | |
---|
2105 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2106 | |
---|
2107 | <h4><a name="Preferred_orientation"><span style='mso-fareast-font-family:"Times New Roman"'>Preferred |
---|
2108 | Orientation </span></a></h4> |
---|
2109 | |
---|
2110 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2111 | plot shows... <o:p></o:p></span></p> |
---|
2112 | |
---|
2113 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2114 | |
---|
2115 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
2116 | |
---|
2117 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
2118 | |
---|
2119 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
2120 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
2121 | |
---|
2122 | <hr size=2 width="100%" align=center> |
---|
2123 | |
---|
2124 | </span></div> |
---|
2125 | |
---|
2126 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><!-- hhmts start -->Last |
---|
2127 | modified: Tue Nov 22 13:19:47 CST 2011 <o:p></o:p></span></p> |
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2128 | |
---|
2129 | <!-- hhmts end --></div> |
---|
2130 | |
---|
2131 | </body> |
---|
2132 | |
---|
2133 | </html> |
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