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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:"Cambria Math"; |
---|
351 | panose-1:2 4 5 3 5 4 6 3 2 4; |
---|
352 | mso-font-charset:0; |
---|
353 | mso-generic-font-family:roman; |
---|
354 | mso-font-pitch:variable; |
---|
355 | mso-font-signature:-536870145 1107305727 0 0 415 0;} |
---|
356 | @font-face |
---|
357 | {font-family:Cambria; |
---|
358 | panose-1:2 4 5 3 5 4 6 3 2 4; |
---|
359 | mso-font-charset:0; |
---|
360 | mso-generic-font-family:roman; |
---|
361 | mso-font-pitch:variable; |
---|
362 | mso-font-signature:-536870145 1073743103 0 0 415 0;} |
---|
363 | @font-face |
---|
364 | {font-family:Tahoma; |
---|
365 | panose-1:2 11 6 4 3 5 4 4 2 4; |
---|
366 | mso-font-charset:0; |
---|
367 | mso-generic-font-family:swiss; |
---|
368 | mso-font-pitch:variable; |
---|
369 | mso-font-signature:-520081665 -1073717157 41 0 66047 0;} |
---|
370 | /* Style Definitions */ |
---|
371 | p.MsoNormal, li.MsoNormal, div.MsoNormal |
---|
372 | {mso-style-unhide:no; |
---|
373 | mso-style-qformat:yes; |
---|
374 | mso-style-parent:""; |
---|
375 | margin:0in; |
---|
376 | margin-bottom:.0001pt; |
---|
377 | mso-pagination:widow-orphan; |
---|
378 | font-size:12.0pt; |
---|
379 | font-family:"Times New Roman","serif"; |
---|
380 | mso-fareast-font-family:"Times New Roman"; |
---|
381 | mso-fareast-theme-font:minor-fareast;} |
---|
382 | h1 |
---|
383 | {mso-style-priority:9; |
---|
384 | mso-style-unhide:no; |
---|
385 | mso-style-qformat:yes; |
---|
386 | mso-style-link:"Heading 1 Char"; |
---|
387 | mso-margin-top-alt:auto; |
---|
388 | margin-right:0in; |
---|
389 | mso-margin-bottom-alt:auto; |
---|
390 | margin-left:0in; |
---|
391 | mso-pagination:widow-orphan; |
---|
392 | mso-outline-level:1; |
---|
393 | font-size:24.0pt; |
---|
394 | font-family:"Times New Roman","serif"; |
---|
395 | mso-fareast-font-family:"Times New Roman"; |
---|
396 | mso-fareast-theme-font:minor-fareast; |
---|
397 | font-weight:bold;} |
---|
398 | h2 |
---|
399 | {mso-style-priority:9; |
---|
400 | mso-style-unhide:no; |
---|
401 | mso-style-qformat:yes; |
---|
402 | mso-style-link:"Heading 2 Char"; |
---|
403 | mso-margin-top-alt:auto; |
---|
404 | margin-right:0in; |
---|
405 | mso-margin-bottom-alt:auto; |
---|
406 | margin-left:0in; |
---|
407 | mso-pagination:widow-orphan; |
---|
408 | mso-outline-level:2; |
---|
409 | font-size:18.0pt; |
---|
410 | font-family:"Times New Roman","serif"; |
---|
411 | mso-fareast-font-family:"Times New Roman"; |
---|
412 | mso-fareast-theme-font:minor-fareast; |
---|
413 | font-weight:bold;} |
---|
414 | h3 |
---|
415 | {mso-style-priority:9; |
---|
416 | mso-style-unhide:no; |
---|
417 | mso-style-qformat:yes; |
---|
418 | mso-style-link:"Heading 3 Char"; |
---|
419 | mso-margin-top-alt:auto; |
---|
420 | margin-right:0in; |
---|
421 | mso-margin-bottom-alt:auto; |
---|
422 | margin-left:0in; |
---|
423 | mso-pagination:widow-orphan; |
---|
424 | mso-outline-level:3; |
---|
425 | font-size:13.5pt; |
---|
426 | font-family:"Times New Roman","serif"; |
---|
427 | mso-fareast-font-family:"Times New Roman"; |
---|
428 | mso-fareast-theme-font:minor-fareast; |
---|
429 | font-weight:bold;} |
---|
430 | h4 |
---|
431 | {mso-style-priority:9; |
---|
432 | mso-style-qformat:yes; |
---|
433 | mso-style-link:"Heading 4 Char"; |
---|
434 | mso-style-next:Normal; |
---|
435 | margin-top:10.0pt; |
---|
436 | margin-right:0in; |
---|
437 | margin-bottom:0in; |
---|
438 | margin-left:0in; |
---|
439 | margin-bottom:.0001pt; |
---|
440 | mso-pagination:widow-orphan lines-together; |
---|
441 | page-break-after:avoid; |
---|
442 | mso-outline-level:4; |
---|
443 | font-size:13.0pt; |
---|
444 | font-family:"Cambria","serif"; |
---|
445 | mso-ascii-font-family:Cambria; |
---|
446 | mso-ascii-theme-font:major-latin; |
---|
447 | mso-fareast-font-family:"Times New Roman"; |
---|
448 | mso-fareast-theme-font:major-fareast; |
---|
449 | mso-hansi-font-family:Cambria; |
---|
450 | mso-hansi-theme-font:major-latin; |
---|
451 | mso-bidi-font-family:"Times New Roman"; |
---|
452 | mso-bidi-theme-font:major-bidi; |
---|
453 | color:#4F81BD; |
---|
454 | mso-themecolor:accent1; |
---|
455 | font-weight:bold; |
---|
456 | font-style:italic;} |
---|
457 | h5 |
---|
458 | {mso-style-noshow:yes; |
---|
459 | mso-style-priority:9; |
---|
460 | mso-style-qformat:yes; |
---|
461 | mso-style-link:"Heading 5 Char"; |
---|
462 | mso-margin-top-alt:auto; |
---|
463 | margin-right:0in; |
---|
464 | mso-margin-bottom-alt:auto; |
---|
465 | margin-left:0in; |
---|
466 | mso-pagination:widow-orphan; |
---|
467 | mso-outline-level:5; |
---|
468 | font-size:12.0pt; |
---|
469 | font-family:"Times New Roman","serif"; |
---|
470 | mso-fareast-font-family:"Times New Roman"; |
---|
471 | mso-fareast-theme-font:minor-fareast; |
---|
472 | color:#4F4FFF; |
---|
473 | font-weight:bold;} |
---|
474 | a:link, span.MsoHyperlink |
---|
475 | {mso-style-priority:99; |
---|
476 | color:blue; |
---|
477 | text-decoration:underline; |
---|
478 | text-underline:single;} |
---|
479 | a:visited, span.MsoHyperlinkFollowed |
---|
480 | {mso-style-noshow:yes; |
---|
481 | mso-style-priority:99; |
---|
482 | color:purple; |
---|
483 | text-decoration:underline; |
---|
484 | text-underline:single;} |
---|
485 | p.MsoDocumentMap, li.MsoDocumentMap, div.MsoDocumentMap |
---|
486 | {mso-style-noshow:yes; |
---|
487 | mso-style-priority:99; |
---|
488 | mso-style-link:"Document Map Char"; |
---|
489 | margin:0in; |
---|
490 | margin-bottom:.0001pt; |
---|
491 | mso-pagination:widow-orphan; |
---|
492 | font-size:8.0pt; |
---|
493 | font-family:"Tahoma","sans-serif"; |
---|
494 | mso-fareast-font-family:"Times New Roman"; |
---|
495 | mso-fareast-theme-font:minor-fareast;} |
---|
496 | p |
---|
497 | {mso-style-noshow:yes; |
---|
498 | mso-style-priority:99; |
---|
499 | mso-margin-top-alt:auto; |
---|
500 | margin-right:0in; |
---|
501 | mso-margin-bottom-alt:auto; |
---|
502 | margin-left:0in; |
---|
503 | mso-pagination:widow-orphan; |
---|
504 | font-size:12.0pt; |
---|
505 | font-family:"Times New Roman","serif"; |
---|
506 | mso-fareast-font-family:"Times New Roman"; |
---|
507 | mso-fareast-theme-font:minor-fareast;} |
---|
508 | pre |
---|
509 | {mso-style-noshow:yes; |
---|
510 | mso-style-priority:99; |
---|
511 | mso-style-link:"HTML Preformatted Char"; |
---|
512 | margin:0in; |
---|
513 | margin-bottom:.0001pt; |
---|
514 | mso-pagination:widow-orphan; |
---|
515 | 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; |
---|
516 | font-size:10.0pt; |
---|
517 | font-family:"Courier New"; |
---|
518 | mso-fareast-font-family:"Times New Roman";} |
---|
519 | p.MsoAcetate, li.MsoAcetate, div.MsoAcetate |
---|
520 | {mso-style-noshow:yes; |
---|
521 | mso-style-priority:99; |
---|
522 | mso-style-link:"Balloon Text Char"; |
---|
523 | margin:0in; |
---|
524 | margin-bottom:.0001pt; |
---|
525 | mso-pagination:widow-orphan; |
---|
526 | font-size:8.0pt; |
---|
527 | font-family:"Tahoma","sans-serif"; |
---|
528 | mso-fareast-font-family:"Times New Roman"; |
---|
529 | mso-fareast-theme-font:minor-fareast;} |
---|
530 | span.MsoPlaceholderText |
---|
531 | {mso-style-noshow:yes; |
---|
532 | mso-style-priority:99; |
---|
533 | mso-style-unhide:no; |
---|
534 | color:gray;} |
---|
535 | p.MsoNoSpacing, li.MsoNoSpacing, div.MsoNoSpacing |
---|
536 | {mso-style-noshow:yes; |
---|
537 | mso-style-priority:1; |
---|
538 | mso-style-unhide:no; |
---|
539 | mso-style-qformat:yes; |
---|
540 | mso-style-parent:""; |
---|
541 | margin:0in; |
---|
542 | margin-bottom:.0001pt; |
---|
543 | mso-pagination:widow-orphan; |
---|
544 | font-size:12.0pt; |
---|
545 | font-family:"Times New Roman","serif"; |
---|
546 | mso-fareast-font-family:"Times New Roman"; |
---|
547 | mso-fareast-theme-font:minor-fareast;} |
---|
548 | p.MsoListParagraph, li.MsoListParagraph, div.MsoListParagraph |
---|
549 | {mso-style-noshow:yes; |
---|
550 | mso-style-priority:34; |
---|
551 | mso-style-unhide:no; |
---|
552 | mso-style-qformat:yes; |
---|
553 | margin-top:0in; |
---|
554 | margin-right:0in; |
---|
555 | margin-bottom:0in; |
---|
556 | margin-left:.5in; |
---|
557 | margin-bottom:.0001pt; |
---|
558 | mso-add-space:auto; |
---|
559 | mso-pagination:widow-orphan; |
---|
560 | font-size:12.0pt; |
---|
561 | font-family:"Times New Roman","serif"; |
---|
562 | mso-fareast-font-family:"Times New Roman"; |
---|
563 | mso-fareast-theme-font:minor-fareast;} |
---|
564 | p.MsoListParagraphCxSpFirst, li.MsoListParagraphCxSpFirst, div.MsoListParagraphCxSpFirst |
---|
565 | {mso-style-noshow:yes; |
---|
566 | mso-style-priority:34; |
---|
567 | mso-style-unhide:no; |
---|
568 | mso-style-qformat:yes; |
---|
569 | mso-style-type:export-only; |
---|
570 | margin-top:0in; |
---|
571 | margin-right:0in; |
---|
572 | margin-bottom:0in; |
---|
573 | margin-left:.5in; |
---|
574 | margin-bottom:.0001pt; |
---|
575 | mso-add-space:auto; |
---|
576 | mso-pagination:widow-orphan; |
---|
577 | font-size:12.0pt; |
---|
578 | font-family:"Times New Roman","serif"; |
---|
579 | mso-fareast-font-family:"Times New Roman"; |
---|
580 | mso-fareast-theme-font:minor-fareast;} |
---|
581 | p.MsoListParagraphCxSpMiddle, li.MsoListParagraphCxSpMiddle, div.MsoListParagraphCxSpMiddle |
---|
582 | {mso-style-noshow:yes; |
---|
583 | mso-style-priority:34; |
---|
584 | mso-style-unhide:no; |
---|
585 | mso-style-qformat:yes; |
---|
586 | mso-style-type:export-only; |
---|
587 | margin-top:0in; |
---|
588 | margin-right:0in; |
---|
589 | margin-bottom:0in; |
---|
590 | margin-left:.5in; |
---|
591 | margin-bottom:.0001pt; |
---|
592 | mso-add-space:auto; |
---|
593 | mso-pagination:widow-orphan; |
---|
594 | font-size:12.0pt; |
---|
595 | font-family:"Times New Roman","serif"; |
---|
596 | mso-fareast-font-family:"Times New Roman"; |
---|
597 | mso-fareast-theme-font:minor-fareast;} |
---|
598 | p.MsoListParagraphCxSpLast, li.MsoListParagraphCxSpLast, div.MsoListParagraphCxSpLast |
---|
599 | {mso-style-noshow:yes; |
---|
600 | mso-style-priority:34; |
---|
601 | mso-style-unhide:no; |
---|
602 | mso-style-qformat:yes; |
---|
603 | mso-style-type:export-only; |
---|
604 | margin-top:0in; |
---|
605 | margin-right:0in; |
---|
606 | margin-bottom:0in; |
---|
607 | margin-left:.5in; |
---|
608 | margin-bottom:.0001pt; |
---|
609 | mso-add-space:auto; |
---|
610 | mso-pagination:widow-orphan; |
---|
611 | font-size:12.0pt; |
---|
612 | font-family:"Times New Roman","serif"; |
---|
613 | mso-fareast-font-family:"Times New Roman"; |
---|
614 | mso-fareast-theme-font:minor-fareast;} |
---|
615 | span.Heading1Char |
---|
616 | {mso-style-name:"Heading 1 Char"; |
---|
617 | mso-style-priority:9; |
---|
618 | mso-style-unhide:no; |
---|
619 | mso-style-locked:yes; |
---|
620 | mso-style-link:"Heading 1"; |
---|
621 | mso-ansi-font-size:14.0pt; |
---|
622 | mso-bidi-font-size:14.0pt; |
---|
623 | font-family:"Cambria","serif"; |
---|
624 | mso-ascii-font-family:Cambria; |
---|
625 | mso-ascii-theme-font:major-latin; |
---|
626 | mso-fareast-font-family:"Times New Roman"; |
---|
627 | mso-fareast-theme-font:major-fareast; |
---|
628 | mso-hansi-font-family:Cambria; |
---|
629 | mso-hansi-theme-font:major-latin; |
---|
630 | mso-bidi-font-family:"Times New Roman"; |
---|
631 | mso-bidi-theme-font:major-bidi; |
---|
632 | color:#365F91; |
---|
633 | mso-themecolor:accent1; |
---|
634 | mso-themeshade:191; |
---|
635 | font-weight:bold;} |
---|
636 | span.Heading2Char |
---|
637 | {mso-style-name:"Heading 2 Char"; |
---|
638 | mso-style-noshow:yes; |
---|
639 | mso-style-priority:9; |
---|
640 | mso-style-unhide:no; |
---|
641 | mso-style-locked:yes; |
---|
642 | mso-style-link:"Heading 2"; |
---|
643 | mso-ansi-font-size:13.0pt; |
---|
644 | mso-bidi-font-size:13.0pt; |
---|
645 | font-family:"Cambria","serif"; |
---|
646 | mso-ascii-font-family:Cambria; |
---|
647 | mso-ascii-theme-font:major-latin; |
---|
648 | mso-fareast-font-family:"Times New Roman"; |
---|
649 | mso-fareast-theme-font:major-fareast; |
---|
650 | mso-hansi-font-family:Cambria; |
---|
651 | mso-hansi-theme-font:major-latin; |
---|
652 | mso-bidi-font-family:"Times New Roman"; |
---|
653 | mso-bidi-theme-font:major-bidi; |
---|
654 | color:#4F81BD; |
---|
655 | mso-themecolor:accent1; |
---|
656 | font-weight:bold;} |
---|
657 | span.Heading3Char |
---|
658 | {mso-style-name:"Heading 3 Char"; |
---|
659 | mso-style-noshow:yes; |
---|
660 | mso-style-priority:9; |
---|
661 | mso-style-unhide:no; |
---|
662 | mso-style-locked:yes; |
---|
663 | mso-style-link:"Heading 3"; |
---|
664 | mso-ansi-font-size:12.0pt; |
---|
665 | mso-bidi-font-size:12.0pt; |
---|
666 | font-family:"Cambria","serif"; |
---|
667 | mso-ascii-font-family:Cambria; |
---|
668 | mso-ascii-theme-font:major-latin; |
---|
669 | mso-fareast-font-family:"Times New Roman"; |
---|
670 | mso-fareast-theme-font:major-fareast; |
---|
671 | mso-hansi-font-family:Cambria; |
---|
672 | mso-hansi-theme-font:major-latin; |
---|
673 | mso-bidi-font-family:"Times New Roman"; |
---|
674 | mso-bidi-theme-font:major-bidi; |
---|
675 | color:#4F81BD; |
---|
676 | mso-themecolor:accent1; |
---|
677 | font-weight:bold;} |
---|
678 | span.Heading4Char |
---|
679 | {mso-style-name:"Heading 4 Char"; |
---|
680 | mso-style-priority:9; |
---|
681 | mso-style-unhide:no; |
---|
682 | mso-style-locked:yes; |
---|
683 | mso-style-link:"Heading 4"; |
---|
684 | mso-ansi-font-size:12.0pt; |
---|
685 | mso-bidi-font-size:12.0pt; |
---|
686 | font-family:"Cambria","serif"; |
---|
687 | mso-ascii-font-family:Cambria; |
---|
688 | mso-ascii-theme-font:major-latin; |
---|
689 | mso-fareast-font-family:"Times New Roman"; |
---|
690 | mso-fareast-theme-font:major-fareast; |
---|
691 | mso-hansi-font-family:Cambria; |
---|
692 | mso-hansi-theme-font:major-latin; |
---|
693 | mso-bidi-font-family:"Times New Roman"; |
---|
694 | mso-bidi-theme-font:major-bidi; |
---|
695 | color:#4F81BD; |
---|
696 | mso-themecolor:accent1; |
---|
697 | font-weight:bold; |
---|
698 | font-style:italic;} |
---|
699 | span.Heading5Char |
---|
700 | {mso-style-name:"Heading 5 Char"; |
---|
701 | mso-style-noshow:yes; |
---|
702 | mso-style-priority:9; |
---|
703 | mso-style-unhide:no; |
---|
704 | mso-style-locked:yes; |
---|
705 | mso-style-link:"Heading 5"; |
---|
706 | mso-ansi-font-size:12.0pt; |
---|
707 | mso-bidi-font-size:12.0pt; |
---|
708 | font-family:"Cambria","serif"; |
---|
709 | mso-ascii-font-family:Cambria; |
---|
710 | mso-ascii-theme-font:major-latin; |
---|
711 | mso-fareast-font-family:"Times New Roman"; |
---|
712 | mso-fareast-theme-font:major-fareast; |
---|
713 | mso-hansi-font-family:Cambria; |
---|
714 | mso-hansi-theme-font:major-latin; |
---|
715 | mso-bidi-font-family:"Times New Roman"; |
---|
716 | mso-bidi-theme-font:major-bidi; |
---|
717 | color:#243F60; |
---|
718 | mso-themecolor:accent1; |
---|
719 | mso-themeshade:127;} |
---|
720 | span.HTMLPreformattedChar |
---|
721 | {mso-style-name:"HTML Preformatted Char"; |
---|
722 | mso-style-noshow:yes; |
---|
723 | mso-style-priority:99; |
---|
724 | mso-style-unhide:no; |
---|
725 | mso-style-locked:yes; |
---|
726 | mso-style-link:"HTML Preformatted"; |
---|
727 | font-family:"Courier New"; |
---|
728 | mso-ascii-font-family:"Courier New"; |
---|
729 | mso-hansi-font-family:"Courier New"; |
---|
730 | mso-bidi-font-family:"Courier New";} |
---|
731 | span.DocumentMapChar |
---|
732 | {mso-style-name:"Document Map Char"; |
---|
733 | mso-style-noshow:yes; |
---|
734 | mso-style-priority:99; |
---|
735 | mso-style-unhide:no; |
---|
736 | mso-style-locked:yes; |
---|
737 | mso-style-link:"Document Map"; |
---|
738 | mso-ansi-font-size:8.0pt; |
---|
739 | mso-bidi-font-size:8.0pt; |
---|
740 | font-family:"Tahoma","sans-serif"; |
---|
741 | mso-ascii-font-family:Tahoma; |
---|
742 | mso-fareast-font-family:"Times New Roman"; |
---|
743 | mso-fareast-theme-font:minor-fareast; |
---|
744 | mso-hansi-font-family:Tahoma; |
---|
745 | mso-bidi-font-family:Tahoma;} |
---|
746 | span.BalloonTextChar |
---|
747 | {mso-style-name:"Balloon Text Char"; |
---|
748 | mso-style-noshow:yes; |
---|
749 | mso-style-priority:99; |
---|
750 | mso-style-unhide:no; |
---|
751 | mso-style-locked:yes; |
---|
752 | mso-style-link:"Balloon Text"; |
---|
753 | mso-ansi-font-size:8.0pt; |
---|
754 | mso-bidi-font-size:8.0pt; |
---|
755 | font-family:"Tahoma","sans-serif"; |
---|
756 | mso-ascii-font-family:Tahoma; |
---|
757 | mso-fareast-font-family:"Times New Roman"; |
---|
758 | mso-fareast-theme-font:minor-fareast; |
---|
759 | mso-hansi-font-family:Tahoma; |
---|
760 | mso-bidi-font-family:Tahoma;} |
---|
761 | span.SpellE |
---|
762 | {mso-style-name:""; |
---|
763 | mso-spl-e:yes;} |
---|
764 | span.GramE |
---|
765 | {mso-style-name:""; |
---|
766 | mso-gram-e:yes;} |
---|
767 | .MsoChpDefault |
---|
768 | {mso-style-type:export-only; |
---|
769 | mso-default-props:yes; |
---|
770 | font-size:10.0pt; |
---|
771 | mso-ansi-font-size:10.0pt; |
---|
772 | mso-bidi-font-size:10.0pt;} |
---|
773 | @page WordSection1 |
---|
774 | {size:8.5in 11.0in; |
---|
775 | margin:1.0in 1.0in 1.0in 1.0in; |
---|
776 | mso-header-margin:.5in; |
---|
777 | mso-footer-margin:.5in; |
---|
778 | mso-paper-source:0;} |
---|
779 | div.WordSection1 |
---|
780 | {page:WordSection1;} |
---|
781 | /* List Definitions */ |
---|
782 | @list l0 |
---|
783 | {mso-list-id:142163818; |
---|
784 | mso-list-type:hybrid; |
---|
785 | mso-list-template-ids:773461610 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
786 | @list l0:level1 |
---|
787 | {mso-level-tab-stop:none; |
---|
788 | mso-level-number-position:left; |
---|
789 | text-indent:-.25in;} |
---|
790 | @list l0:level2 |
---|
791 | {mso-level-number-format:alpha-lower; |
---|
792 | mso-level-tab-stop:none; |
---|
793 | mso-level-number-position:left; |
---|
794 | text-indent:-.25in;} |
---|
795 | @list l0:level3 |
---|
796 | {mso-level-number-format:roman-lower; |
---|
797 | mso-level-tab-stop:none; |
---|
798 | mso-level-number-position:right; |
---|
799 | text-indent:-9.0pt;} |
---|
800 | @list l0:level4 |
---|
801 | {mso-level-tab-stop:2.0in; |
---|
802 | mso-level-number-position:left; |
---|
803 | text-indent:-.25in;} |
---|
804 | @list l0:level5 |
---|
805 | {mso-level-tab-stop:2.5in; |
---|
806 | mso-level-number-position:left; |
---|
807 | text-indent:-.25in;} |
---|
808 | @list l0:level6 |
---|
809 | {mso-level-tab-stop:3.0in; |
---|
810 | mso-level-number-position:left; |
---|
811 | text-indent:-.25in;} |
---|
812 | @list l0:level7 |
---|
813 | {mso-level-tab-stop:3.5in; |
---|
814 | mso-level-number-position:left; |
---|
815 | text-indent:-.25in;} |
---|
816 | @list l0:level8 |
---|
817 | {mso-level-tab-stop:4.0in; |
---|
818 | mso-level-number-position:left; |
---|
819 | text-indent:-.25in;} |
---|
820 | @list l0:level9 |
---|
821 | {mso-level-tab-stop:4.5in; |
---|
822 | mso-level-number-position:left; |
---|
823 | text-indent:-.25in;} |
---|
824 | @list l1 |
---|
825 | {mso-list-id:203979460; |
---|
826 | mso-list-template-ids:88359672;} |
---|
827 | @list l1:level1 |
---|
828 | {mso-level-number-format:bullet; |
---|
829 | mso-level-text:\F0B7; |
---|
830 | mso-level-tab-stop:.5in; |
---|
831 | mso-level-number-position:left; |
---|
832 | text-indent:-.25in; |
---|
833 | mso-ansi-font-size:10.0pt; |
---|
834 | font-family:Symbol;} |
---|
835 | @list l1:level2 |
---|
836 | {mso-level-tab-stop:1.0in; |
---|
837 | mso-level-number-position:left; |
---|
838 | text-indent:-.25in;} |
---|
839 | @list l1:level3 |
---|
840 | {mso-level-tab-stop:1.5in; |
---|
841 | mso-level-number-position:left; |
---|
842 | text-indent:-.25in;} |
---|
843 | @list l1:level4 |
---|
844 | {mso-level-tab-stop:2.0in; |
---|
845 | mso-level-number-position:left; |
---|
846 | text-indent:-.25in;} |
---|
847 | @list l1:level5 |
---|
848 | {mso-level-tab-stop:2.5in; |
---|
849 | mso-level-number-position:left; |
---|
850 | text-indent:-.25in;} |
---|
851 | @list l1:level6 |
---|
852 | {mso-level-tab-stop:3.0in; |
---|
853 | mso-level-number-position:left; |
---|
854 | text-indent:-.25in;} |
---|
855 | @list l1:level7 |
---|
856 | {mso-level-tab-stop:3.5in; |
---|
857 | mso-level-number-position:left; |
---|
858 | text-indent:-.25in;} |
---|
859 | @list l1:level8 |
---|
860 | {mso-level-tab-stop:4.0in; |
---|
861 | mso-level-number-position:left; |
---|
862 | text-indent:-.25in;} |
---|
863 | @list l1:level9 |
---|
864 | {mso-level-tab-stop:4.5in; |
---|
865 | mso-level-number-position:left; |
---|
866 | text-indent:-.25in;} |
---|
867 | @list l2 |
---|
868 | {mso-list-id:268514595; |
---|
869 | mso-list-type:hybrid; |
---|
870 | mso-list-template-ids:-1814001090 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
871 | @list l2:level1 |
---|
872 | {mso-level-number-format:alpha-lower; |
---|
873 | mso-level-tab-stop:none; |
---|
874 | mso-level-number-position:left; |
---|
875 | margin-left:1.0in; |
---|
876 | text-indent:-.25in; |
---|
877 | mso-ansi-font-weight:normal;} |
---|
878 | @list l2:level2 |
---|
879 | {mso-level-tab-stop:1.0in; |
---|
880 | mso-level-number-position:left; |
---|
881 | text-indent:-.25in;} |
---|
882 | @list l2:level3 |
---|
883 | {mso-level-tab-stop:112.5pt; |
---|
884 | mso-level-number-position:left; |
---|
885 | margin-left:112.5pt; |
---|
886 | text-indent:-.25in;} |
---|
887 | @list l2:level4 |
---|
888 | {mso-level-tab-stop:2.0in; |
---|
889 | mso-level-number-position:left; |
---|
890 | text-indent:-.25in;} |
---|
891 | @list l2:level5 |
---|
892 | {mso-level-tab-stop:2.5in; |
---|
893 | mso-level-number-position:left; |
---|
894 | text-indent:-.25in;} |
---|
895 | @list l2:level6 |
---|
896 | {mso-level-tab-stop:3.0in; |
---|
897 | mso-level-number-position:left; |
---|
898 | text-indent:-.25in;} |
---|
899 | @list l2:level7 |
---|
900 | {mso-level-tab-stop:3.5in; |
---|
901 | mso-level-number-position:left; |
---|
902 | text-indent:-.25in;} |
---|
903 | @list l2:level8 |
---|
904 | {mso-level-tab-stop:4.0in; |
---|
905 | mso-level-number-position:left; |
---|
906 | text-indent:-.25in;} |
---|
907 | @list l2:level9 |
---|
908 | {mso-level-tab-stop:4.5in; |
---|
909 | mso-level-number-position:left; |
---|
910 | text-indent:-.25in;} |
---|
911 | @list l3 |
---|
912 | {mso-list-id:301277244; |
---|
913 | mso-list-template-ids:-445226636;} |
---|
914 | @list l3:level1 |
---|
915 | {mso-level-tab-stop:none; |
---|
916 | mso-level-number-position:left; |
---|
917 | text-indent:-.25in;} |
---|
918 | @list l3:level2 |
---|
919 | {mso-level-number-format:alpha-lower; |
---|
920 | mso-level-tab-stop:1.0in; |
---|
921 | mso-level-number-position:left; |
---|
922 | text-indent:-.25in;} |
---|
923 | @list l3:level3 |
---|
924 | {mso-level-tab-stop:1.5in; |
---|
925 | mso-level-number-position:left; |
---|
926 | text-indent:-.25in;} |
---|
927 | @list l3:level4 |
---|
928 | {mso-level-number-format:alpha-lower; |
---|
929 | mso-level-tab-stop:2.0in; |
---|
930 | mso-level-number-position:left; |
---|
931 | text-indent:-.25in;} |
---|
932 | @list l3:level5 |
---|
933 | {mso-level-tab-stop:2.5in; |
---|
934 | mso-level-number-position:left; |
---|
935 | text-indent:-.25in;} |
---|
936 | @list l3:level6 |
---|
937 | {mso-level-tab-stop:3.0in; |
---|
938 | mso-level-number-position:left; |
---|
939 | text-indent:-.25in;} |
---|
940 | @list l3:level7 |
---|
941 | {mso-level-tab-stop:3.5in; |
---|
942 | mso-level-number-position:left; |
---|
943 | text-indent:-.25in;} |
---|
944 | @list l3:level8 |
---|
945 | {mso-level-tab-stop:4.0in; |
---|
946 | mso-level-number-position:left; |
---|
947 | text-indent:-.25in;} |
---|
948 | @list l3:level9 |
---|
949 | {mso-level-tab-stop:4.5in; |
---|
950 | mso-level-number-position:left; |
---|
951 | text-indent:-.25in;} |
---|
952 | @list l4 |
---|
953 | {mso-list-id:424421782; |
---|
954 | mso-list-template-ids:-445226636;} |
---|
955 | @list l4:level1 |
---|
956 | {mso-level-tab-stop:none; |
---|
957 | mso-level-number-position:left; |
---|
958 | text-indent:-.25in;} |
---|
959 | @list l4:level2 |
---|
960 | {mso-level-number-format:alpha-lower; |
---|
961 | mso-level-tab-stop:1.0in; |
---|
962 | mso-level-number-position:left; |
---|
963 | text-indent:-.25in;} |
---|
964 | @list l4:level3 |
---|
965 | {mso-level-tab-stop:1.5in; |
---|
966 | mso-level-number-position:left; |
---|
967 | text-indent:-.25in;} |
---|
968 | @list l4:level4 |
---|
969 | {mso-level-number-format:alpha-lower; |
---|
970 | mso-level-tab-stop:2.0in; |
---|
971 | mso-level-number-position:left; |
---|
972 | text-indent:-.25in;} |
---|
973 | @list l4:level5 |
---|
974 | {mso-level-tab-stop:2.5in; |
---|
975 | mso-level-number-position:left; |
---|
976 | text-indent:-.25in;} |
---|
977 | @list l4:level6 |
---|
978 | {mso-level-tab-stop:3.0in; |
---|
979 | mso-level-number-position:left; |
---|
980 | text-indent:-.25in;} |
---|
981 | @list l4:level7 |
---|
982 | {mso-level-tab-stop:3.5in; |
---|
983 | mso-level-number-position:left; |
---|
984 | text-indent:-.25in;} |
---|
985 | @list l4:level8 |
---|
986 | {mso-level-tab-stop:4.0in; |
---|
987 | mso-level-number-position:left; |
---|
988 | text-indent:-.25in;} |
---|
989 | @list l4:level9 |
---|
990 | {mso-level-tab-stop:4.5in; |
---|
991 | mso-level-number-position:left; |
---|
992 | text-indent:-.25in;} |
---|
993 | @list l5 |
---|
994 | {mso-list-id:617220658; |
---|
995 | mso-list-type:hybrid; |
---|
996 | mso-list-template-ids:1177170962 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
997 | @list l5:level1 |
---|
998 | {mso-level-tab-stop:none; |
---|
999 | mso-level-number-position:left; |
---|
1000 | text-indent:-.25in;} |
---|
1001 | @list l5:level2 |
---|
1002 | {mso-level-tab-stop:1.0in; |
---|
1003 | mso-level-number-position:left; |
---|
1004 | text-indent:-.25in;} |
---|
1005 | @list l5:level3 |
---|
1006 | {mso-level-tab-stop:1.5in; |
---|
1007 | mso-level-number-position:left; |
---|
1008 | text-indent:-.25in;} |
---|
1009 | @list l5:level4 |
---|
1010 | {mso-level-tab-stop:2.0in; |
---|
1011 | mso-level-number-position:left; |
---|
1012 | text-indent:-.25in;} |
---|
1013 | @list l5:level5 |
---|
1014 | {mso-level-tab-stop:2.5in; |
---|
1015 | mso-level-number-position:left; |
---|
1016 | text-indent:-.25in;} |
---|
1017 | @list l5:level6 |
---|
1018 | {mso-level-tab-stop:3.0in; |
---|
1019 | mso-level-number-position:left; |
---|
1020 | text-indent:-.25in;} |
---|
1021 | @list l5:level7 |
---|
1022 | {mso-level-tab-stop:3.5in; |
---|
1023 | mso-level-number-position:left; |
---|
1024 | text-indent:-.25in;} |
---|
1025 | @list l5:level8 |
---|
1026 | {mso-level-tab-stop:4.0in; |
---|
1027 | mso-level-number-position:left; |
---|
1028 | text-indent:-.25in;} |
---|
1029 | @list l5:level9 |
---|
1030 | {mso-level-tab-stop:4.5in; |
---|
1031 | mso-level-number-position:left; |
---|
1032 | text-indent:-.25in;} |
---|
1033 | @list l6 |
---|
1034 | {mso-list-id:649361966; |
---|
1035 | mso-list-template-ids:326264828;} |
---|
1036 | @list l6:level1 |
---|
1037 | {mso-level-tab-stop:none; |
---|
1038 | mso-level-number-position:left; |
---|
1039 | text-indent:-.25in;} |
---|
1040 | @list l6:level2 |
---|
1041 | {mso-level-number-format:alpha-lower; |
---|
1042 | mso-level-tab-stop:1.0in; |
---|
1043 | mso-level-number-position:left; |
---|
1044 | text-indent:-.25in; |
---|
1045 | mso-ansi-font-size:12.0pt; |
---|
1046 | font-family:"Times New Roman","serif"; |
---|
1047 | mso-ansi-font-weight:normal; |
---|
1048 | mso-ansi-font-style:normal;} |
---|
1049 | @list l6:level3 |
---|
1050 | {mso-level-tab-stop:1.5in; |
---|
1051 | mso-level-number-position:left; |
---|
1052 | text-indent:-.25in;} |
---|
1053 | @list l6:level4 |
---|
1054 | {mso-level-number-format:alpha-lower; |
---|
1055 | mso-level-tab-stop:2.0in; |
---|
1056 | mso-level-number-position:left; |
---|
1057 | text-indent:-.25in;} |
---|
1058 | @list l6:level5 |
---|
1059 | {mso-level-tab-stop:2.5in; |
---|
1060 | mso-level-number-position:left; |
---|
1061 | text-indent:-.25in;} |
---|
1062 | @list l6:level6 |
---|
1063 | {mso-level-tab-stop:3.0in; |
---|
1064 | mso-level-number-position:left; |
---|
1065 | text-indent:-.25in;} |
---|
1066 | @list l6:level7 |
---|
1067 | {mso-level-tab-stop:3.5in; |
---|
1068 | mso-level-number-position:left; |
---|
1069 | text-indent:-.25in;} |
---|
1070 | @list l6:level8 |
---|
1071 | {mso-level-tab-stop:4.0in; |
---|
1072 | mso-level-number-position:left; |
---|
1073 | text-indent:-.25in;} |
---|
1074 | @list l6:level9 |
---|
1075 | {mso-level-tab-stop:4.5in; |
---|
1076 | mso-level-number-position:left; |
---|
1077 | text-indent:-.25in;} |
---|
1078 | @list l7 |
---|
1079 | {mso-list-id:656106218; |
---|
1080 | mso-list-type:hybrid; |
---|
1081 | mso-list-template-ids:185874704 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1082 | @list l7:level1 |
---|
1083 | {mso-level-tab-stop:none; |
---|
1084 | mso-level-number-position:left; |
---|
1085 | text-indent:-.25in;} |
---|
1086 | @list l7:level2 |
---|
1087 | {mso-level-tab-stop:1.0in; |
---|
1088 | mso-level-number-position:left; |
---|
1089 | text-indent:-.25in;} |
---|
1090 | @list l7:level3 |
---|
1091 | {mso-level-tab-stop:1.5in; |
---|
1092 | mso-level-number-position:left; |
---|
1093 | text-indent:-.25in;} |
---|
1094 | @list l7:level4 |
---|
1095 | {mso-level-tab-stop:2.0in; |
---|
1096 | mso-level-number-position:left; |
---|
1097 | text-indent:-.25in;} |
---|
1098 | @list l7:level5 |
---|
1099 | {mso-level-tab-stop:2.5in; |
---|
1100 | mso-level-number-position:left; |
---|
1101 | text-indent:-.25in;} |
---|
1102 | @list l7:level6 |
---|
1103 | {mso-level-tab-stop:3.0in; |
---|
1104 | mso-level-number-position:left; |
---|
1105 | text-indent:-.25in;} |
---|
1106 | @list l7:level7 |
---|
1107 | {mso-level-tab-stop:3.5in; |
---|
1108 | mso-level-number-position:left; |
---|
1109 | text-indent:-.25in;} |
---|
1110 | @list l7:level8 |
---|
1111 | {mso-level-tab-stop:4.0in; |
---|
1112 | mso-level-number-position:left; |
---|
1113 | text-indent:-.25in;} |
---|
1114 | @list l7:level9 |
---|
1115 | {mso-level-tab-stop:4.5in; |
---|
1116 | mso-level-number-position:left; |
---|
1117 | text-indent:-.25in;} |
---|
1118 | @list l8 |
---|
1119 | {mso-list-id:734669460; |
---|
1120 | mso-list-type:hybrid; |
---|
1121 | mso-list-template-ids:1988758972 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1122 | @list l8:level1 |
---|
1123 | {mso-level-tab-stop:none; |
---|
1124 | mso-level-number-position:left; |
---|
1125 | text-indent:-.25in;} |
---|
1126 | @list l8:level2 |
---|
1127 | {mso-level-tab-stop:1.0in; |
---|
1128 | mso-level-number-position:left; |
---|
1129 | text-indent:-.25in;} |
---|
1130 | @list l8:level3 |
---|
1131 | {mso-level-tab-stop:1.5in; |
---|
1132 | mso-level-number-position:left; |
---|
1133 | text-indent:-.25in;} |
---|
1134 | @list l8:level4 |
---|
1135 | {mso-level-tab-stop:2.0in; |
---|
1136 | mso-level-number-position:left; |
---|
1137 | text-indent:-.25in;} |
---|
1138 | @list l8:level5 |
---|
1139 | {mso-level-tab-stop:2.5in; |
---|
1140 | mso-level-number-position:left; |
---|
1141 | text-indent:-.25in;} |
---|
1142 | @list l8:level6 |
---|
1143 | {mso-level-tab-stop:3.0in; |
---|
1144 | mso-level-number-position:left; |
---|
1145 | text-indent:-.25in;} |
---|
1146 | @list l8:level7 |
---|
1147 | {mso-level-tab-stop:3.5in; |
---|
1148 | mso-level-number-position:left; |
---|
1149 | text-indent:-.25in;} |
---|
1150 | @list l8:level8 |
---|
1151 | {mso-level-tab-stop:4.0in; |
---|
1152 | mso-level-number-position:left; |
---|
1153 | text-indent:-.25in;} |
---|
1154 | @list l8:level9 |
---|
1155 | {mso-level-tab-stop:4.5in; |
---|
1156 | mso-level-number-position:left; |
---|
1157 | text-indent:-.25in;} |
---|
1158 | @list l9 |
---|
1159 | {mso-list-id:742676264; |
---|
1160 | mso-list-template-ids:326264828;} |
---|
1161 | @list l9:level1 |
---|
1162 | {mso-level-tab-stop:none; |
---|
1163 | mso-level-number-position:left; |
---|
1164 | text-indent:-.25in;} |
---|
1165 | @list l9:level2 |
---|
1166 | {mso-level-number-format:alpha-lower; |
---|
1167 | mso-level-tab-stop:1.0in; |
---|
1168 | mso-level-number-position:left; |
---|
1169 | text-indent:-.25in; |
---|
1170 | mso-ansi-font-size:12.0pt; |
---|
1171 | font-family:"Times New Roman","serif"; |
---|
1172 | mso-ansi-font-weight:normal; |
---|
1173 | mso-ansi-font-style:normal;} |
---|
1174 | @list l9:level3 |
---|
1175 | {mso-level-tab-stop:1.5in; |
---|
1176 | mso-level-number-position:left; |
---|
1177 | text-indent:-.25in;} |
---|
1178 | @list l9:level4 |
---|
1179 | {mso-level-number-format:alpha-lower; |
---|
1180 | mso-level-tab-stop:2.0in; |
---|
1181 | mso-level-number-position:left; |
---|
1182 | text-indent:-.25in;} |
---|
1183 | @list l9:level5 |
---|
1184 | {mso-level-tab-stop:2.5in; |
---|
1185 | mso-level-number-position:left; |
---|
1186 | text-indent:-.25in;} |
---|
1187 | @list l9:level6 |
---|
1188 | {mso-level-tab-stop:3.0in; |
---|
1189 | mso-level-number-position:left; |
---|
1190 | text-indent:-.25in;} |
---|
1191 | @list l9:level7 |
---|
1192 | {mso-level-tab-stop:3.5in; |
---|
1193 | mso-level-number-position:left; |
---|
1194 | text-indent:-.25in;} |
---|
1195 | @list l9:level8 |
---|
1196 | {mso-level-tab-stop:4.0in; |
---|
1197 | mso-level-number-position:left; |
---|
1198 | text-indent:-.25in;} |
---|
1199 | @list l9:level9 |
---|
1200 | {mso-level-tab-stop:4.5in; |
---|
1201 | mso-level-number-position:left; |
---|
1202 | text-indent:-.25in;} |
---|
1203 | @list l10 |
---|
1204 | {mso-list-id:919948450; |
---|
1205 | mso-list-type:hybrid; |
---|
1206 | mso-list-template-ids:-1980985146 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1207 | @list l10:level1 |
---|
1208 | {mso-level-tab-stop:none; |
---|
1209 | mso-level-number-position:left; |
---|
1210 | text-indent:-.25in;} |
---|
1211 | @list l10:level2 |
---|
1212 | {mso-level-tab-stop:1.0in; |
---|
1213 | mso-level-number-position:left; |
---|
1214 | text-indent:-.25in;} |
---|
1215 | @list l10:level3 |
---|
1216 | {mso-level-tab-stop:1.5in; |
---|
1217 | mso-level-number-position:left; |
---|
1218 | text-indent:-.25in;} |
---|
1219 | @list l10:level4 |
---|
1220 | {mso-level-tab-stop:2.0in; |
---|
1221 | mso-level-number-position:left; |
---|
1222 | text-indent:-.25in;} |
---|
1223 | @list l10:level5 |
---|
1224 | {mso-level-tab-stop:2.5in; |
---|
1225 | mso-level-number-position:left; |
---|
1226 | text-indent:-.25in;} |
---|
1227 | @list l10:level6 |
---|
1228 | {mso-level-tab-stop:3.0in; |
---|
1229 | mso-level-number-position:left; |
---|
1230 | text-indent:-.25in;} |
---|
1231 | @list l10:level7 |
---|
1232 | {mso-level-tab-stop:3.5in; |
---|
1233 | mso-level-number-position:left; |
---|
1234 | text-indent:-.25in;} |
---|
1235 | @list l10:level8 |
---|
1236 | {mso-level-tab-stop:4.0in; |
---|
1237 | mso-level-number-position:left; |
---|
1238 | text-indent:-.25in;} |
---|
1239 | @list l10:level9 |
---|
1240 | {mso-level-tab-stop:4.5in; |
---|
1241 | mso-level-number-position:left; |
---|
1242 | text-indent:-.25in;} |
---|
1243 | @list l11 |
---|
1244 | {mso-list-id:1035230400; |
---|
1245 | mso-list-type:hybrid; |
---|
1246 | mso-list-template-ids:-2012591744 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1247 | @list l11:level1 |
---|
1248 | {mso-level-tab-stop:none; |
---|
1249 | mso-level-number-position:left; |
---|
1250 | text-indent:-.25in;} |
---|
1251 | @list l11:level2 |
---|
1252 | {mso-level-number-format:alpha-lower; |
---|
1253 | mso-level-tab-stop:none; |
---|
1254 | mso-level-number-position:left; |
---|
1255 | text-indent:-.25in;} |
---|
1256 | @list l11:level3 |
---|
1257 | {mso-level-tab-stop:1.5in; |
---|
1258 | mso-level-number-position:left; |
---|
1259 | text-indent:-.25in;} |
---|
1260 | @list l11:level4 |
---|
1261 | {mso-level-tab-stop:2.0in; |
---|
1262 | mso-level-number-position:left; |
---|
1263 | text-indent:-.25in;} |
---|
1264 | @list l11:level5 |
---|
1265 | {mso-level-tab-stop:2.5in; |
---|
1266 | mso-level-number-position:left; |
---|
1267 | text-indent:-.25in;} |
---|
1268 | @list l11:level6 |
---|
1269 | {mso-level-tab-stop:3.0in; |
---|
1270 | mso-level-number-position:left; |
---|
1271 | text-indent:-.25in;} |
---|
1272 | @list l11:level7 |
---|
1273 | {mso-level-tab-stop:3.5in; |
---|
1274 | mso-level-number-position:left; |
---|
1275 | text-indent:-.25in;} |
---|
1276 | @list l11:level8 |
---|
1277 | {mso-level-tab-stop:4.0in; |
---|
1278 | mso-level-number-position:left; |
---|
1279 | text-indent:-.25in;} |
---|
1280 | @list l11:level9 |
---|
1281 | {mso-level-tab-stop:4.5in; |
---|
1282 | mso-level-number-position:left; |
---|
1283 | text-indent:-.25in;} |
---|
1284 | @list l12 |
---|
1285 | {mso-list-id:1074664733; |
---|
1286 | mso-list-type:hybrid; |
---|
1287 | mso-list-template-ids:2033622918 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1288 | @list l12:level1 |
---|
1289 | {mso-level-number-format:alpha-lower; |
---|
1290 | mso-level-tab-stop:none; |
---|
1291 | mso-level-number-position:left; |
---|
1292 | margin-left:1.0in; |
---|
1293 | text-indent:-.25in; |
---|
1294 | mso-ansi-font-weight:normal;} |
---|
1295 | @list l12:level2 |
---|
1296 | {mso-level-number-format:alpha-lower; |
---|
1297 | mso-level-tab-stop:none; |
---|
1298 | mso-level-number-position:left; |
---|
1299 | text-indent:-.25in;} |
---|
1300 | @list l12:level3 |
---|
1301 | {mso-level-tab-stop:1.5in; |
---|
1302 | mso-level-number-position:left; |
---|
1303 | text-indent:-.25in;} |
---|
1304 | @list l12:level4 |
---|
1305 | {mso-level-tab-stop:2.0in; |
---|
1306 | mso-level-number-position:left; |
---|
1307 | text-indent:-.25in;} |
---|
1308 | @list l12:level5 |
---|
1309 | {mso-level-tab-stop:2.5in; |
---|
1310 | mso-level-number-position:left; |
---|
1311 | text-indent:-.25in;} |
---|
1312 | @list l12:level6 |
---|
1313 | {mso-level-tab-stop:3.0in; |
---|
1314 | mso-level-number-position:left; |
---|
1315 | text-indent:-.25in;} |
---|
1316 | @list l12:level7 |
---|
1317 | {mso-level-tab-stop:3.5in; |
---|
1318 | mso-level-number-position:left; |
---|
1319 | text-indent:-.25in;} |
---|
1320 | @list l12:level8 |
---|
1321 | {mso-level-tab-stop:4.0in; |
---|
1322 | mso-level-number-position:left; |
---|
1323 | text-indent:-.25in;} |
---|
1324 | @list l12:level9 |
---|
1325 | {mso-level-tab-stop:4.5in; |
---|
1326 | mso-level-number-position:left; |
---|
1327 | text-indent:-.25in;} |
---|
1328 | @list l13 |
---|
1329 | {mso-list-id:1162892763; |
---|
1330 | mso-list-type:hybrid; |
---|
1331 | mso-list-template-ids:2091276960 -1984140816 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1332 | @list l13:level1 |
---|
1333 | {mso-level-number-format:alpha-lower; |
---|
1334 | mso-level-tab-stop:none; |
---|
1335 | mso-level-number-position:left; |
---|
1336 | margin-left:1.0in; |
---|
1337 | text-indent:-.25in;} |
---|
1338 | @list l13:level2 |
---|
1339 | {mso-level-tab-stop:1.0in; |
---|
1340 | mso-level-number-position:left; |
---|
1341 | text-indent:-.25in;} |
---|
1342 | @list l13:level3 |
---|
1343 | {mso-level-tab-stop:1.5in; |
---|
1344 | mso-level-number-position:left; |
---|
1345 | text-indent:-.25in;} |
---|
1346 | @list l13:level4 |
---|
1347 | {mso-level-tab-stop:2.0in; |
---|
1348 | mso-level-number-position:left; |
---|
1349 | text-indent:-.25in;} |
---|
1350 | @list l13:level5 |
---|
1351 | {mso-level-tab-stop:2.5in; |
---|
1352 | mso-level-number-position:left; |
---|
1353 | text-indent:-.25in;} |
---|
1354 | @list l13:level6 |
---|
1355 | {mso-level-tab-stop:3.0in; |
---|
1356 | mso-level-number-position:left; |
---|
1357 | text-indent:-.25in;} |
---|
1358 | @list l13:level7 |
---|
1359 | {mso-level-tab-stop:3.5in; |
---|
1360 | mso-level-number-position:left; |
---|
1361 | text-indent:-.25in;} |
---|
1362 | @list l13:level8 |
---|
1363 | {mso-level-tab-stop:4.0in; |
---|
1364 | mso-level-number-position:left; |
---|
1365 | text-indent:-.25in;} |
---|
1366 | @list l13:level9 |
---|
1367 | {mso-level-tab-stop:4.5in; |
---|
1368 | mso-level-number-position:left; |
---|
1369 | text-indent:-.25in;} |
---|
1370 | @list l14 |
---|
1371 | {mso-list-id:1323200535; |
---|
1372 | mso-list-type:hybrid; |
---|
1373 | mso-list-template-ids:-720724778 859726762 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1374 | @list l14:level1 |
---|
1375 | {mso-level-number-format:alpha-lower; |
---|
1376 | mso-level-tab-stop:none; |
---|
1377 | mso-level-number-position:left; |
---|
1378 | margin-left:1.0in; |
---|
1379 | text-indent:-.25in;} |
---|
1380 | @list l14:level2 |
---|
1381 | {mso-level-tab-stop:1.0in; |
---|
1382 | mso-level-number-position:left; |
---|
1383 | text-indent:-.25in;} |
---|
1384 | @list l14:level3 |
---|
1385 | {mso-level-tab-stop:1.5in; |
---|
1386 | mso-level-number-position:left; |
---|
1387 | text-indent:-.25in;} |
---|
1388 | @list l14:level4 |
---|
1389 | {mso-level-tab-stop:2.0in; |
---|
1390 | mso-level-number-position:left; |
---|
1391 | text-indent:-.25in;} |
---|
1392 | @list l14:level5 |
---|
1393 | {mso-level-tab-stop:2.5in; |
---|
1394 | mso-level-number-position:left; |
---|
1395 | text-indent:-.25in;} |
---|
1396 | @list l14:level6 |
---|
1397 | {mso-level-tab-stop:3.0in; |
---|
1398 | mso-level-number-position:left; |
---|
1399 | text-indent:-.25in;} |
---|
1400 | @list l14:level7 |
---|
1401 | {mso-level-tab-stop:3.5in; |
---|
1402 | mso-level-number-position:left; |
---|
1403 | text-indent:-.25in;} |
---|
1404 | @list l14:level8 |
---|
1405 | {mso-level-tab-stop:4.0in; |
---|
1406 | mso-level-number-position:left; |
---|
1407 | text-indent:-.25in;} |
---|
1408 | @list l14:level9 |
---|
1409 | {mso-level-tab-stop:4.5in; |
---|
1410 | mso-level-number-position:left; |
---|
1411 | text-indent:-.25in;} |
---|
1412 | @list l15 |
---|
1413 | {mso-list-id:1326516832; |
---|
1414 | mso-list-type:hybrid; |
---|
1415 | mso-list-template-ids:1433942448 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1416 | @list l15:level1 |
---|
1417 | {mso-level-tab-stop:none; |
---|
1418 | mso-level-number-position:left; |
---|
1419 | text-indent:-.25in;} |
---|
1420 | @list l15:level2 |
---|
1421 | {mso-level-tab-stop:1.0in; |
---|
1422 | mso-level-number-position:left; |
---|
1423 | text-indent:-.25in;} |
---|
1424 | @list l15:level3 |
---|
1425 | {mso-level-tab-stop:1.5in; |
---|
1426 | mso-level-number-position:left; |
---|
1427 | text-indent:-.25in;} |
---|
1428 | @list l15:level4 |
---|
1429 | {mso-level-tab-stop:2.0in; |
---|
1430 | mso-level-number-position:left; |
---|
1431 | text-indent:-.25in;} |
---|
1432 | @list l15:level5 |
---|
1433 | {mso-level-tab-stop:2.5in; |
---|
1434 | mso-level-number-position:left; |
---|
1435 | text-indent:-.25in;} |
---|
1436 | @list l15:level6 |
---|
1437 | {mso-level-tab-stop:3.0in; |
---|
1438 | mso-level-number-position:left; |
---|
1439 | text-indent:-.25in;} |
---|
1440 | @list l15:level7 |
---|
1441 | {mso-level-tab-stop:3.5in; |
---|
1442 | mso-level-number-position:left; |
---|
1443 | text-indent:-.25in;} |
---|
1444 | @list l15:level8 |
---|
1445 | {mso-level-tab-stop:4.0in; |
---|
1446 | mso-level-number-position:left; |
---|
1447 | text-indent:-.25in;} |
---|
1448 | @list l15:level9 |
---|
1449 | {mso-level-tab-stop:4.5in; |
---|
1450 | mso-level-number-position:left; |
---|
1451 | text-indent:-.25in;} |
---|
1452 | @list l16 |
---|
1453 | {mso-list-id:1394309879; |
---|
1454 | mso-list-template-ids:326264828;} |
---|
1455 | @list l16:level1 |
---|
1456 | {mso-level-tab-stop:none; |
---|
1457 | mso-level-number-position:left; |
---|
1458 | text-indent:-.25in;} |
---|
1459 | @list l16:level2 |
---|
1460 | {mso-level-number-format:alpha-lower; |
---|
1461 | mso-level-tab-stop:1.0in; |
---|
1462 | mso-level-number-position:left; |
---|
1463 | text-indent:-.25in; |
---|
1464 | mso-ansi-font-size:12.0pt; |
---|
1465 | font-family:"Times New Roman","serif"; |
---|
1466 | mso-ansi-font-weight:normal; |
---|
1467 | mso-ansi-font-style:normal;} |
---|
1468 | @list l16:level3 |
---|
1469 | {mso-level-tab-stop:1.5in; |
---|
1470 | mso-level-number-position:left; |
---|
1471 | text-indent:-.25in;} |
---|
1472 | @list l16:level4 |
---|
1473 | {mso-level-number-format:alpha-lower; |
---|
1474 | mso-level-tab-stop:2.0in; |
---|
1475 | mso-level-number-position:left; |
---|
1476 | text-indent:-.25in;} |
---|
1477 | @list l16:level5 |
---|
1478 | {mso-level-tab-stop:2.5in; |
---|
1479 | mso-level-number-position:left; |
---|
1480 | text-indent:-.25in;} |
---|
1481 | @list l16:level6 |
---|
1482 | {mso-level-tab-stop:3.0in; |
---|
1483 | mso-level-number-position:left; |
---|
1484 | text-indent:-.25in;} |
---|
1485 | @list l16:level7 |
---|
1486 | {mso-level-tab-stop:3.5in; |
---|
1487 | mso-level-number-position:left; |
---|
1488 | text-indent:-.25in;} |
---|
1489 | @list l16:level8 |
---|
1490 | {mso-level-tab-stop:4.0in; |
---|
1491 | mso-level-number-position:left; |
---|
1492 | text-indent:-.25in;} |
---|
1493 | @list l16:level9 |
---|
1494 | {mso-level-tab-stop:4.5in; |
---|
1495 | mso-level-number-position:left; |
---|
1496 | text-indent:-.25in;} |
---|
1497 | @list l17 |
---|
1498 | {mso-list-id:1602683002; |
---|
1499 | mso-list-type:hybrid; |
---|
1500 | mso-list-template-ids:120980256 67698703 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1501 | @list l17:level1 |
---|
1502 | {mso-level-tab-stop:none; |
---|
1503 | mso-level-number-position:left; |
---|
1504 | text-indent:-.25in;} |
---|
1505 | @list l17:level2 |
---|
1506 | {mso-level-number-format:alpha-lower; |
---|
1507 | mso-level-tab-stop:none; |
---|
1508 | mso-level-number-position:left; |
---|
1509 | text-indent:-.25in;} |
---|
1510 | @list l17:level3 |
---|
1511 | {mso-level-tab-stop:1.5in; |
---|
1512 | mso-level-number-position:left; |
---|
1513 | text-indent:-.25in;} |
---|
1514 | @list l17:level4 |
---|
1515 | {mso-level-tab-stop:2.0in; |
---|
1516 | mso-level-number-position:left; |
---|
1517 | text-indent:-.25in;} |
---|
1518 | @list l17:level5 |
---|
1519 | {mso-level-tab-stop:2.5in; |
---|
1520 | mso-level-number-position:left; |
---|
1521 | text-indent:-.25in;} |
---|
1522 | @list l17:level6 |
---|
1523 | {mso-level-tab-stop:3.0in; |
---|
1524 | mso-level-number-position:left; |
---|
1525 | text-indent:-.25in;} |
---|
1526 | @list l17:level7 |
---|
1527 | {mso-level-tab-stop:3.5in; |
---|
1528 | mso-level-number-position:left; |
---|
1529 | text-indent:-.25in;} |
---|
1530 | @list l17:level8 |
---|
1531 | {mso-level-tab-stop:4.0in; |
---|
1532 | mso-level-number-position:left; |
---|
1533 | text-indent:-.25in;} |
---|
1534 | @list l17:level9 |
---|
1535 | {mso-level-tab-stop:4.5in; |
---|
1536 | mso-level-number-position:left; |
---|
1537 | text-indent:-.25in;} |
---|
1538 | @list l18 |
---|
1539 | {mso-list-id:1669404025; |
---|
1540 | mso-list-type:hybrid; |
---|
1541 | mso-list-template-ids:-1814001090 1141245230 67698713 67698715 67698703 67698713 67698715 67698703 67698713 67698715;} |
---|
1542 | @list l18:level1 |
---|
1543 | {mso-level-number-format:alpha-lower; |
---|
1544 | mso-level-tab-stop:none; |
---|
1545 | mso-level-number-position:left; |
---|
1546 | margin-left:1.0in; |
---|
1547 | text-indent:-.25in; |
---|
1548 | mso-ansi-font-weight:normal;} |
---|
1549 | @list l18:level2 |
---|
1550 | {mso-level-tab-stop:1.0in; |
---|
1551 | mso-level-number-position:left; |
---|
1552 | text-indent:-.25in;} |
---|
1553 | @list l18:level3 |
---|
1554 | {mso-level-tab-stop:112.5pt; |
---|
1555 | mso-level-number-position:left; |
---|
1556 | margin-left:112.5pt; |
---|
1557 | text-indent:-.25in;} |
---|
1558 | @list l18:level4 |
---|
1559 | {mso-level-tab-stop:2.0in; |
---|
1560 | mso-level-number-position:left; |
---|
1561 | text-indent:-.25in;} |
---|
1562 | @list l18:level5 |
---|
1563 | {mso-level-tab-stop:2.5in; |
---|
1564 | mso-level-number-position:left; |
---|
1565 | text-indent:-.25in;} |
---|
1566 | @list l18:level6 |
---|
1567 | {mso-level-tab-stop:3.0in; |
---|
1568 | mso-level-number-position:left; |
---|
1569 | text-indent:-.25in;} |
---|
1570 | @list l18:level7 |
---|
1571 | {mso-level-tab-stop:3.5in; |
---|
1572 | mso-level-number-position:left; |
---|
1573 | text-indent:-.25in;} |
---|
1574 | @list l18:level8 |
---|
1575 | {mso-level-tab-stop:4.0in; |
---|
1576 | mso-level-number-position:left; |
---|
1577 | text-indent:-.25in;} |
---|
1578 | @list l18:level9 |
---|
1579 | {mso-level-tab-stop:4.5in; |
---|
1580 | mso-level-number-position:left; |
---|
1581 | text-indent:-.25in;} |
---|
1582 | @list l19 |
---|
1583 | {mso-list-id:1753089587; |
---|
1584 | mso-list-template-ids:1555050902;} |
---|
1585 | @list l19:level1 |
---|
1586 | {mso-level-tab-stop:none; |
---|
1587 | mso-level-number-position:left; |
---|
1588 | text-indent:-.25in;} |
---|
1589 | @list l19:level2 |
---|
1590 | {mso-level-tab-stop:1.0in; |
---|
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---|
1741 | ol |
---|
1742 | {margin-bottom:0in;} |
---|
1743 | ul |
---|
1744 | {margin-bottom:0in;} |
---|
1745 | --> |
---|
1746 | </style> |
---|
1747 | <!--[if gte mso 10]> |
---|
1748 | <style> |
---|
1749 | /* Style Definitions */ |
---|
1750 | table.MsoNormalTable |
---|
1751 | {mso-style-name:"Table Normal"; |
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---|
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---|
1761 | font-size:10.0pt; |
---|
1762 | font-family:"Times New Roman","serif";} |
---|
1763 | </style> |
---|
1764 | <![endif]--> |
---|
1765 | <link href=gsasIIfav.png rel="SHORTCUT ICON"> |
---|
1766 | <!--[if gte mso 9]><xml> |
---|
1767 | <o:shapedefaults v:ext="edit" spidmax="1027"/> |
---|
1768 | </xml><![endif]--><!--[if gte mso 9]><xml> |
---|
1769 | <o:shapelayout v:ext="edit"> |
---|
1770 | <o:idmap v:ext="edit" data="1"/> |
---|
1771 | </o:shapelayout></xml><![endif]--> |
---|
1772 | </head> |
---|
1773 | |
---|
1774 | <body lang=EN-US link=blue vlink=purple style='tab-interval:.5in'> |
---|
1775 | |
---|
1776 | <div class=WordSection1> |
---|
1777 | |
---|
1778 | <h1><!--[if gte vml 1]><v:shapetype id="_x0000_t75" coordsize="21600,21600" |
---|
1779 | o:spt="75" o:preferrelative="t" path="m@4@5l@4@11@9@11@9@5xe" filled="f" |
---|
1780 | stroked="f"> |
---|
1781 | <v:stroke joinstyle="miter"/> |
---|
1782 | <v:formulas> |
---|
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---|
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---|
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---|
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---|
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---|
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---|
1793 | <v:f eqn="prod @7 21600 pixelHeight"/> |
---|
1794 | <v:f eqn="sum @10 21600 0"/> |
---|
1795 | </v:formulas> |
---|
1796 | <v:path o:extrusionok="f" gradientshapeok="t" o:connecttype="rect"/> |
---|
1797 | <o:lock v:ext="edit" aspectratio="t"/> |
---|
1798 | </v:shapetype><v:shape id="Picture_x0020_2" o:spid="_x0000_s1026" type="#_x0000_t75" |
---|
1799 | alt="Description: GSAS-II logo" style='position:absolute;margin-left:44.8pt; |
---|
1800 | margin-top:0;width:96pt;height:96pt;z-index:251657728;visibility:visible; |
---|
1801 | mso-wrap-style:square;mso-width-percent:0;mso-height-percent:0; |
---|
1802 | mso-wrap-distance-left:0;mso-wrap-distance-top:0;mso-wrap-distance-right:0; |
---|
1803 | mso-wrap-distance-bottom:0;mso-position-horizontal:right; |
---|
1804 | mso-position-horizontal-relative:text;mso-position-vertical:absolute; |
---|
1805 | mso-position-vertical-relative:line;mso-width-percent:0;mso-height-percent:0; |
---|
1806 | mso-width-relative:page;mso-height-relative:page' o:allowoverlap="f"> |
---|
1807 | <v:imagedata src="gsas2logo.png"/> |
---|
1808 | <w:wrap type="square" anchory="line"/> |
---|
1809 | </v:shape><![endif]--><![if !vml]><img width=128 height=128 src=gsas2logo.png |
---|
1810 | align=right alt="Description: GSAS-II logo" v:shapes="Picture_x0020_2"><![endif]><span |
---|
1811 | style='mso-fareast-font-family:"Times New Roman"'>Help for GSAS-II<o:p></o:p></span></h1> |
---|
1812 | |
---|
1813 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1814 | is where to find help on various GSAS-II windows and plots. Note that GSAS-II |
---|
1815 | operates with four windows: the main <a href="#Data_tree">GSAS-II data tree</a> |
---|
1816 | window, which provides a hierarchical view of the current project; the <a |
---|
1817 | href="#Data_Frame">GSAS-II data editing</a> window, which shows the contents of |
---|
1818 | a particular section of the project, where values can be examined and changed; |
---|
1819 | the <a href="#Plots">GSAS-II Plots</a> window, which shows graphical |
---|
1820 | representations of the results; and the console which has printout information |
---|
1821 | that can be selected, cut & pasted into a document. <o:p></o:p></span></p> |
---|
1822 | |
---|
1823 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1824 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1825 | |
---|
1826 | <hr size=2 width="100%" align=center> |
---|
1827 | |
---|
1828 | </span></div> |
---|
1829 | |
---|
1830 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
1831 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
1832 | |
---|
1833 | <hr size=2 width="100%" align=center> |
---|
1834 | |
---|
1835 | </span></div> |
---|
1836 | |
---|
1837 | <h2><a name="Data_tree"></a><span style='mso-fareast-font-family:"Times New Roman"'>1. |
---|
1838 | GSAS-II data tree<o:p></o:p></span></h2> |
---|
1839 | |
---|
1840 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
1841 | is a hierarchical view of the data items in your GSAS-II project (name.gpx). |
---|
1842 | Clicking on any item in the tree opens a window where information in that item |
---|
1843 | can be viewed or edited. For example, the <a href="#Sample_Parameters">"Sample |
---|
1844 | Parameters"</a> item under a ‘PWDR’ entry contains information |
---|
1845 | about how data were collected, such as the sample temperature <a |
---|
1846 | href="#Sample_Parameters">(see below)</a>. The arrow keys (up & down) move |
---|
1847 | the selection to successive entries in the data tree; both the data window and |
---|
1848 | the associated plot (if any) will change.<o:p></o:p></span></p> |
---|
1849 | |
---|
1850 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h4> |
---|
1851 | |
---|
1852 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
---|
1853 | menus associated with this window provide access to many features of GSAS-II, |
---|
1854 | as outlined below: <o:p></o:p></span></p> |
---|
1855 | |
---|
1856 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
---|
1857 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
1858 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1859 | ‘<b style='mso-bidi-font-weight:normal'>File</b>’ – </p> |
---|
1860 | |
---|
1861 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1862 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1863 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1864 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1865 | style='mso-bidi-font-weight:normal'>Open project…</b> - Open a previously |
---|
1866 | saved GSAS-II project file (name.gpx). If you currently have a project file |
---|
1867 | open, you are asked if it is OK to over write it; Cancel will cancel the |
---|
1868 | process. <b style='mso-bidi-font-weight:normal'>NB</b>: you may open a backup <span |
---|
1869 | class=SpellE>gpx</span> file (e.g. name.bak3.gpx) to recover a previous version |
---|
1870 | of your project. Remember to <b style='mso-bidi-font-weight:normal'>Save As</b>… |
---|
1871 | to e.g. name.gpx to overwrite the current version. Otherwise you may get |
---|
1872 | backups of your backup file (e.g. name.bak3.bak0.gpx, etc.).</p> |
---|
1873 | |
---|
1874 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1875 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1876 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1877 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1878 | style='mso-bidi-font-weight:normal'>Save project</b> – Save the current |
---|
1879 | project. If a file name is shown after ‘Loaded Data:’ in the data |
---|
1880 | tree<span style='mso-fareast-font-family:"Times New Roman"'>, it will be saved |
---|
1881 | there. Otherwise, you will be prompted for a new name in a file dialog (you may |
---|
1882 | change directory as well). If the file exists, you will be asked if it OK to |
---|
1883 | overwrite.</span></p> |
---|
1884 | |
---|
1885 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1886 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1887 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1888 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1889 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Save |
---|
1890 | As…</span></b><span style='mso-fareast-font-family:"Times New Roman"'> - |
---|
1891 | Save the current project to a new file. A file dialog will be shown to enter |
---|
1892 | the name (and change directory if desired). If the file exists, you will be |
---|
1893 | asked if it OK to overwrite.</span></p> |
---|
1894 | |
---|
1895 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1896 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1897 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1898 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1899 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Close |
---|
1900 | project</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
1901 | – Close the current project; you will be asked if you want to save it |
---|
1902 | first.</span></p> |
---|
1903 | |
---|
1904 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1905 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1906 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1907 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1908 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Exit</span></b><span |
---|
1909 | style='mso-fareast-font-family:"Times New Roman"'> – Exit the GSAS-II |
---|
1910 | program; if there is a current project you will be asked if you want to save it |
---|
1911 | first. Pressing the red X in the upper right (Windows) also exits (no save option) |
---|
1912 | GSAS-II; useful for escaping from GSAS-II if needed.</span></p> |
---|
1913 | |
---|
1914 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
---|
1915 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
1916 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
1917 | ‘<b style='mso-bidi-font-weight:normal'>Data</b>’ – </p> |
---|
1918 | |
---|
1919 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1920 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1921 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
1922 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1923 | style='mso-bidi-font-weight:normal'>Read powder data…</b> - Read in |
---|
1924 | powder diffraction patterns (multiple patterns can be selected). GSAS-II can |
---|
1925 | read most of the old GSAS powder format files with the position in <span |
---|
1926 | class=SpellE>centidegrees</span> 2-theta. It can also read “<span |
---|
1927 | class=SpellE>xye</span>” format files used by <span class=SpellE>topas</span> |
---|
1928 | where the position is in degrees 2-theta. As each file is read, an old GSAS |
---|
1929 | style “instrument parameter file” is searched for; if not found a <span |
---|
1930 | class=SpellE>CuK</span><span style='font-family:Symbol'>a</span> laboratory |
---|
1931 | data set is assumed. </p> |
---|
1932 | |
---|
1933 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1934 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1935 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
1936 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1937 | style='mso-bidi-font-weight:normal'>Read image data…</b> - Read in 2-D |
---|
1938 | powder diffraction images (multiple patterns can be selected). GSAS-II can read |
---|
1939 | many different image file formats including MAR345 files, Quantum ADSC files, |
---|
1940 | and tiff files from Perkin-Elmer, Pilatus, and GE. Although many of these |
---|
1941 | formats have data fields that should contain relevant information for the |
---|
1942 | exposure (e.g. wavelength), these are rarely filled in correctly by the data |
---|
1943 | acquisition software. Thus, you should have separately noted this information |
---|
1944 | as it will be needed</p> |
---|
1945 | |
---|
1946 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1947 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1948 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
1949 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1950 | style='mso-bidi-font-weight:normal'>Read Powder Pattern Peaks…</b> - Read |
---|
1951 | in a list of powder pattern peak positions as either a d-spacing table or a set |
---|
1952 | of 2<span style='font-family:Symbol'>Q</span> positions; these can be used in |
---|
1953 | GSAS-II powder pattern indexing. </p> |
---|
1954 | |
---|
1955 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1956 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1957 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
1958 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1959 | style='mso-bidi-font-weight:normal'>Read single crystal data…</b> - </p> |
---|
1960 | |
---|
1961 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1962 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1963 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
1964 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1965 | style='mso-bidi-font-weight:normal'>Sum powder data</b> - </p> |
---|
1966 | |
---|
1967 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1968 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1969 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
1970 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1971 | style='mso-bidi-font-weight:normal'>Sum image data</b> - </p> |
---|
1972 | |
---|
1973 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1974 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1975 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
---|
1976 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1977 | style='mso-bidi-font-weight:normal'>Add phase</b> – This begins the |
---|
1978 | creation of a new phase in the data tree (under Phases). You are first prompted |
---|
1979 | in a dialog box for a name to be assigned to the new phase. Then the <b |
---|
1980 | style='mso-bidi-font-weight:normal'><a href="#General">General</a></b> tab is |
---|
1981 | opened for this phase; you should first select the phase type, enter the space |
---|
1982 | group symbol and then lattice parameters. Note that nonstandard space group |
---|
1983 | symbols are permitted; there must be spaces between the axial fields (e.g. use |
---|
1984 | ‘P n a 21’ not ‘Pna21’).</p> |
---|
1985 | |
---|
1986 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1987 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1988 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
---|
1989 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
1990 | style='mso-bidi-font-weight:normal'>Delete phase</b> – This will remove a |
---|
1991 | phase from the data tree. A dialog box will present the list of phases; pick |
---|
1992 | one (or more) to delete.</p> |
---|
1993 | |
---|
1994 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
1995 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
1996 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
---|
1997 | style='font:7.0pt "Times New Roman"'> |
---|
1998 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Rename |
---|
1999 | data</b> – This might be a bad idea!!</p> |
---|
2000 | |
---|
2001 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2002 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2003 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
---|
2004 | style='font:7.0pt "Times New Roman"'> |
---|
2005 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Delete |
---|
2006 | data</b> – This will remove an item from the data tree. A dialog box with |
---|
2007 | a list of choices is presented.</p> |
---|
2008 | |
---|
2009 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
---|
2010 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2011 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
2012 | ‘<b style='mso-bidi-font-weight:normal'>Calculate</b>’ – </p> |
---|
2013 | |
---|
2014 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2015 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2016 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2017 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2018 | style='mso-bidi-font-weight:normal'>Make new PDFs</b> – This creates the |
---|
2019 | pair distribution function (PDF) controls for each powder pattern selected in |
---|
2020 | the dialog box. See <b style='mso-bidi-font-weight:normal'><span |
---|
2021 | style='color:#4F81BD;mso-themecolor:accent1'><a href="#PDF_Controls">PDF |
---|
2022 | Controls</a></span></b> for further directions.</p> |
---|
2023 | |
---|
2024 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2025 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2026 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2027 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2028 | style='mso-bidi-font-weight:normal'>View LS <span class=SpellE>parms</span></b> |
---|
2029 | – This shows a dialog box with all the parameters for your project; those |
---|
2030 | to be refined are flagged ‘True’, otherwise ‘False’. |
---|
2031 | Blanks indicate parameters that are not <span class=SpellE>refinable</span>. |
---|
2032 | The total number of refined parameters is also shown at the top of the list. |
---|
2033 | The value of each parameter is also given. The parameter names are of the form |
---|
2034 | ‘p<span class=GramE>:h:name:id’</span> where ‘p’ is the |
---|
2035 | phase index, ‘h’ is the histogram index and ‘id’ is the |
---|
2036 | item index (if needed). Indexes all begin with ‘0’ (zero). Note |
---|
2037 | that for atom positions the value is not a <span class=SpellE>refinable</span> |
---|
2038 | parameter, but the shift in the value is. Position names are, e.g. ‘0:<span |
---|
2039 | class=GramE>:Ax:0’</span> for the x-position of the <span class=SpellE>zeroth</span> |
---|
2040 | atom in the <span class=SpellE>zeroth</span> phase while shift names have a |
---|
2041 | ‘d’ in then, e.g. ‘0::dAx:0’. </p> |
---|
2042 | |
---|
2043 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2044 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2045 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
2046 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2047 | style='mso-bidi-font-weight:normal'>Refine</b> – This performs the |
---|
2048 | refinement (Pawley/Rietveld or single crystal) according to the controls set in |
---|
2049 | the <b style='mso-bidi-font-weight:normal'><a href="#Controls">Controls</a></b> |
---|
2050 | data tree item.</p> |
---|
2051 | |
---|
2052 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2053 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2054 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
2055 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2056 | style='mso-bidi-font-weight:normal'>Sequential refine</b> – This starts a |
---|
2057 | sequential refinement with the data sets selected in the <b style='mso-bidi-font-weight: |
---|
2058 | normal'><a href="#Controls">Controls</a></b> data tree item.</p> |
---|
2059 | |
---|
2060 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
---|
2061 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
2062 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
2063 | ‘<b style='mso-bidi-font-weight:normal'>Import</b>’ – </p> |
---|
2064 | |
---|
2065 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2066 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2067 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2068 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2069 | style='mso-bidi-font-weight:normal'>Import Phase (specific) - </b></p> |
---|
2070 | |
---|
2071 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
---|
2072 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
---|
2073 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2074 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2075 | style='mso-bidi-font-weight:normal'>Import Phase GSAS.EXP… - </b>This |
---|
2076 | reads one phase from a GSAS experiment file (name.EXP). The file name is found |
---|
2077 | in a directory dialog; you can change directories as needed. Only .EXP (or |
---|
2078 | .exp) file names are shown. If the selected file has more than one phase, a |
---|
2079 | dialog is shown with the choices; only one can be chosen. If you want more than |
---|
2080 | one, redo the <b style='mso-bidi-font-weight:normal'>Import Phase GSAS.EXP</b> |
---|
2081 | command. After selecting a phase, a dialog box is shown with the proposed phase |
---|
2082 | name. You can change it if desired.</p> |
---|
2083 | |
---|
2084 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
---|
2085 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
---|
2086 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2087 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2088 | style='mso-bidi-font-weight:normal'>Import Phase PDB…</b> - This reads |
---|
2089 | the macromolecular phase information from a Protein Data Base file (name.PDB or |
---|
2090 | name.ENT). The file name is found in a directory dialog; you can change |
---|
2091 | directories as needed. Only .PDB or .ENT file names are shown. Be careful that |
---|
2092 | the space group symbol on the ‘CRYST1’ record in the PDB file |
---|
2093 | follows the GSAS-II conventions (e.g. with spaces between axial fields). A |
---|
2094 | dialog box is shown with the proposed phase name. You can change it if desired.</p> |
---|
2095 | |
---|
2096 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
---|
2097 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
---|
2098 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2099 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2100 | style='mso-bidi-font-weight:normal'>Import Phase CIF…</b> This reads one |
---|
2101 | phase from a Crystallographic Information File (name.CIF). The file name is |
---|
2102 | found in a directory dialog; you can change directories as needed. Only .CIF |
---|
2103 | (or .<span class=SpellE>cif</span>) file names are shown. If the selected file |
---|
2104 | has more than one phase, a dialog is shown with the choices; only one can be |
---|
2105 | chosen. If you want more than one, redo the <b style='mso-bidi-font-weight: |
---|
2106 | normal'>Import Phase CIF</b> command. After selecting a phase, a dialog box is |
---|
2107 | shown with the proposed phase name. You can change it if desired.</p> |
---|
2108 | |
---|
2109 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.5in;mso-add-space: |
---|
2110 | auto;text-indent:-.25in;mso-list:l11 level3 lfo1;tab-stops:list 1.5in'><![if !supportLists]><span |
---|
2111 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
2112 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2113 | style='mso-bidi-font-weight:normal'>Import Phase GSAS-II <span class=SpellE>gpx</span>…</b> |
---|
2114 | This reads one phase from a GSAS-II project file (name.GPX). The file name is |
---|
2115 | found in a directory dialog; you can change directories as needed. Only .GPX |
---|
2116 | (or .<span class=SpellE>gpx</span>) file names are shown. If the selected file |
---|
2117 | has more than one phase, a dialog is shown with the choices; only one can be |
---|
2118 | chosen. If you want more than one, redo the <b style='mso-bidi-font-weight: |
---|
2119 | normal'>Import Phase GSAS-II <span class=SpellE>gpx</span></b> command. After |
---|
2120 | selecting a phase, a dialog box is shown with the proposed phase name. You can |
---|
2121 | change it if desired.</p> |
---|
2122 | |
---|
2123 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2124 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2125 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2126 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2127 | style='mso-bidi-font-weight:normal'>Import Powder Pattern…</b> - </p> |
---|
2128 | |
---|
2129 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2130 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2131 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
2132 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2133 | style='mso-bidi-font-weight:normal'>Import HKLs…</b> - </p> |
---|
2134 | |
---|
2135 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l11 level1 lfo1'><![if !supportLists]><span |
---|
2136 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
2137 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
2138 | ‘<b style='mso-bidi-font-weight:normal'>Export</b>’ –</p> |
---|
2139 | |
---|
2140 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2141 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2142 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2143 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2144 | style='mso-bidi-font-weight:normal'>Export Powder Patterns…</b> - </p> |
---|
2145 | |
---|
2146 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2147 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2148 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2149 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2150 | style='mso-bidi-font-weight:normal'>Export All Peak Lists…</b> - </p> |
---|
2151 | |
---|
2152 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2153 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2154 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
2155 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2156 | style='mso-bidi-font-weight:normal'>Export HKLs…</b> - </p> |
---|
2157 | |
---|
2158 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2159 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2160 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
2161 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2162 | style='mso-bidi-font-weight:normal'>Export PDF…</b> - </p> |
---|
2163 | |
---|
2164 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2165 | auto;text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2166 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
2167 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2168 | style='mso-bidi-font-weight:normal'>Export Phase…</b> - </p> |
---|
2169 | |
---|
2170 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
2171 | text-indent:-.25in;mso-list:l11 level2 lfo1'><![if !supportLists]><span |
---|
2172 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
2173 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2174 | style='mso-bidi-font-weight:normal'>Export CIF…</b> - </p> |
---|
2175 | |
---|
2176 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
2177 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
2178 | |
---|
2179 | <hr size=2 width="100%" align=center> |
---|
2180 | |
---|
2181 | </span></div> |
---|
2182 | |
---|
2183 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
2184 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
2185 | |
---|
2186 | <hr size=2 width="100%" align=center> |
---|
2187 | |
---|
2188 | </span></div> |
---|
2189 | |
---|
2190 | <h2><a name="Data_Frame"><span style='mso-fareast-font-family:"Times New Roman"'>2. |
---|
2191 | GSAS-II Data Editing Window</span></a><span style='mso-fareast-font-family: |
---|
2192 | "Times New Roman"'><o:p></o:p></span></h2> |
---|
2193 | |
---|
2194 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Different |
---|
2195 | information is displayed in the Data Editing Window, depending on which section |
---|
2196 | of the <a href="#Data_tree">data tree</a> is selected. For example, clicking on |
---|
2197 | the "Notebook" entry of the tree brings up the Notebook editing |
---|
2198 | window described below. <o:p></o:p></span></p> |
---|
2199 | |
---|
2200 | <h4><a name=Notebook><span style='mso-fareast-font-family:"Times New Roman"'>Notebook</span></a><span |
---|
2201 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
2202 | |
---|
2203 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2204 | window provides a place for you to enter whatever text commentary you wish. |
---|
2205 | Each time you enter this window, a date/time entry is provided for you. A |
---|
2206 | possibly useful technique is to select a portion of the console window after a |
---|
2207 | refinement completes (it will contain refinement results with residuals, new |
---|
2208 | values & <span class=SpellE>esds</span>) and paste it into this Notebook |
---|
2209 | window so it becomes a part of your project file.<o:p></o:p></span></p> |
---|
2210 | |
---|
2211 | <h4><a name=Controls><span style='mso-fareast-font-family:"Times New Roman"'>Controls</span></a><span |
---|
2212 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
2213 | |
---|
2214 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2215 | window provides the main controls for the major calculations in GSAS-II. At |
---|
2216 | present only Refinement Controls are presented. <o:p></o:p></span></p> |
---|
2217 | |
---|
2218 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Two |
---|
2219 | of the main refinement tools are the <span class=SpellE><span class=GramE>fortran</span></span> |
---|
2220 | MINPACK <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
---|
2221 | algorithms wrapped in python as provided in the <span class=SpellE>Scipy</span> |
---|
2222 | package and a third one is a python version utilizing only the <span |
---|
2223 | class=SpellE>numpy</span> package. The purpose is to </span>minimize the sum of |
---|
2224 | the squares of M<span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2225 | nonlinear functions in N variables by a modification of the <span class=SpellE>Levenberg</span>-Marquardt |
---|
2226 | algorithm. The <span class=SpellE>lmdif</span> and <span class=SpellE>lmder</span> |
---|
2227 | routines were written by </span>Burton S. <span class=SpellE>Garbow</span>, |
---|
2228 | Kenneth E. <span class=SpellE>Hillstrom</span>, <span class=GramE>Jorge</span> |
---|
2229 | J. <span class=GramE>More (Argonne National Laboratory, 1980).</span> The |
---|
2230 | python/numpy version was developed by us based on the material in Numerical |
---|
2231 | Recipes (Press, Flannery, <span class=SpellE><span class=GramE>Teulosky</span></span> |
---|
2232 | & <span class=SpellE>Vetterling</span>) for the <span class=SpellE>Levenberg</span>-Marquardt |
---|
2233 | algorithm.<span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></p> |
---|
2234 | |
---|
2235 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2236 | |
---|
2237 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
---|
2238 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2239 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2240 | style='mso-fareast-font-family:"Times New Roman"'>Select whether the refinement |
---|
2241 | uses ‘analytic <span class=SpellE>Jacobian</span>’, ‘analytic |
---|
2242 | Hessian’ or ‘numeric’ derivatives. The last is slower and |
---|
2243 | perhaps a bit less accurate, but may be needed if the analytic functions are |
---|
2244 | not fully developed. The <span class=SpellE>Jacobian</span> matrix is shaped N |
---|
2245 | x M (parameters x observations) and is much larger than the Hessian matrix |
---|
2246 | which is shaped M x M (parameters x parameters). Generally use ‘analytic |
---|
2247 | Hessian’ for routine work.<o:p></o:p></span></p> |
---|
2248 | |
---|
2249 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
---|
2250 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2251 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2252 | style='mso-fareast-font-family:"Times New Roman"'>Select ‘Min |
---|
2253 | delta-M/M’ for convergence; the refinement will stop when the change in |
---|
2254 | the minimization function is less than this value. Set Min delta-M/M = 1.0 to |
---|
2255 | force just a single cycle to be performed. A value less than 10<sup>-4</sup> |
---|
2256 | (the default) generally gives no better result. The allowed range is 10<sup>-9</sup> |
---|
2257 | to 1.0.<o:p></o:p></span></p> |
---|
2258 | |
---|
2259 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
---|
2260 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2261 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2262 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic |
---|
2263 | Jacobean’ is chosen then select ‘Initial shift factor’ for |
---|
2264 | the first cycle of refinement. This value is modified by the least squares |
---|
2265 | routine. The allowed range is 10<sup>-5</sup> to 100. Smaller values may be |
---|
2266 | needed if your initial <span class=GramE>refinement</span> trials immediately diverge, |
---|
2267 | however make sure your starting parameter values are ‘reasonable’. |
---|
2268 | The selected default (=1.0) normally gives good performance.<o:p></o:p></span></p> |
---|
2269 | |
---|
2270 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
---|
2271 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
2272 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2273 | style='mso-fareast-font-family:"Times New Roman"'>If ‘analytic |
---|
2274 | Hessian’ is chosen then select ‘Max cycles’, the maximum |
---|
2275 | number of least squares cycles to be performed. Least squares cycles are |
---|
2276 | determined by the number of times a new Hessian matrix is computes; the <span |
---|
2277 | class=SpellE>Levenberg</span>-Marquardt algorithm may compute the function |
---|
2278 | several times between cycles as it finds the optimal value of the Marquardt |
---|
2279 | coefficient. Choices are given in the pull down selection; the default is 3 |
---|
2280 | cycles.<o:p></o:p></span></p> |
---|
2281 | |
---|
2282 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l15 level1 lfo2'><![if !supportLists]><span |
---|
2283 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
2284 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2285 | style='mso-fareast-font-family:"Times New Roman"'>Select data for sequential |
---|
2286 | refinement; the data sets may be done in ‘reverse order’. <o:p></o:p></span></p> |
---|
2287 | |
---|
2288 | <h4>Covariance<span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
2289 | |
---|
2290 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2291 | window is blank; the GSASII Plots window ‘<a href="#Covariance">Covariance’</a> |
---|
2292 | shows a graphical representation of the variance-covariance matrix <o:p></o:p></span></p> |
---|
2293 | |
---|
2294 | <h4><a name=Constraints><span style='mso-fareast-font-family:"Times New Roman"'>Constraints<o:p></o:p></span></a></h4> |
---|
2295 | |
---|
2296 | <span style='mso-bookmark:Constraints'></span> |
---|
2297 | |
---|
2298 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2299 | window shows the constraints to be used in a refinement. It is organized into |
---|
2300 | three tabbed pages. ‘Phase constraints’ contain those involving |
---|
2301 | parameters that describe aspects of the crystalline phases to be used in the |
---|
2302 | refinement (e.g. atom coordinates, thermal motion and site fraction |
---|
2303 | parameters). ‘Histogram/Phase constraints’ are those which describe |
---|
2304 | aspects of the pattern that depend on both the phase and the data set used in |
---|
2305 | the refinement (e.g. </span><span style='font-family:Symbol;mso-fareast-font-family: |
---|
2306 | "Times New Roman"'>m</span><span style='mso-fareast-font-family:"Times New Roman"'>strain |
---|
2307 | and crystallite size parameters). ‘Histogram constraints’ are those |
---|
2308 | that depend only on the data set (e.g. profile coefficients U<span class=GramE>,V,W,X</span> |
---|
2309 | and Y).<o:p></o:p></span></p> |
---|
2310 | |
---|
2311 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2312 | |
---|
2313 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l17 level1 lfo3'><![if !supportLists]><span |
---|
2314 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2315 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2316 | style='mso-fareast-font-family:"Times New Roman"'>Select the tab for the |
---|
2317 | parameter types you wish to constrain. Each will have the same possibilities in |
---|
2318 | the ‘Edit menu.<o:p></o:p></span></p> |
---|
2319 | |
---|
2320 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l17 level1 lfo3'><![if !supportLists]><span |
---|
2321 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2322 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2323 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
2324 | style='mso-bidi-font-weight:normal'>Edit</b>’ – <o:p></o:p></span></p> |
---|
2325 | |
---|
2326 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2327 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
---|
2328 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2329 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2330 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
2331 | "Times New Roman"'>Add</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
2332 | style='mso-fareast-font-family:"Times New Roman"'> Hold</span></b><span |
---|
2333 | style='mso-fareast-font-family:"Times New Roman"'> – select a parameter |
---|
2334 | that you wish to remain fixed although other parameters of the same type may be |
---|
2335 | selected as a group for refinement. For example, if the space group for a phase |
---|
2336 | has a polar axis (e.g. the b-axis in P2<sub>1</sub>), then one atom y-parameter |
---|
2337 | is arbitrary and should be selected for a Hold to keep the structure from |
---|
2338 | drifting up or down the y-axis during refinement. If selected, a dialog box |
---|
2339 | will appear showing the list of available parameters; select one and then OK to |
---|
2340 | implement it, Cancel will cancel the operation. The held parameter will be |
---|
2341 | shown in the constraint window with the keyword ‘FIXED’. A Delete |
---|
2342 | button can be used to remove it.<o:p></o:p></span></p> |
---|
2343 | |
---|
2344 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2345 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
---|
2346 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2347 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2348 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
2349 | equivalence</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2350 | – select a list of parameters that should have the same value (possibly |
---|
2351 | with a non-unitary multiplier for some). Examples are a list of atoms with the |
---|
2352 | same thermal motion <span class=SpellE>Uiso</span>, sets of profile |
---|
2353 | coefficients U<span class=GramE>,V,W</span> across multiple data sets. If |
---|
2354 | selected, a dialog box will appear with a list of the available parameters. |
---|
2355 | Select one and press OK; a second dialog box will appear with only those |
---|
2356 | parameters that can be made equivalent to the first one. Choose those and press |
---|
2357 | OK. Cancel in either dialog will cancel the operation. The equivalenced |
---|
2358 | 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; |
---|
2359 | usually M1=1.0 and M2=-1.0, but can be changed via the ‘Edit’ |
---|
2360 | button. The keyword ‘EQUIV’ marks it as <span class=GramE>an |
---|
2361 | equivalence</span>. A Delete button can be used to remove it.<o:p></o:p></span></p> |
---|
2362 | |
---|
2363 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2364 | auto;text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
---|
2365 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
2366 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2367 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
2368 | constraint</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2369 | – select a list of parameters whose sum (with possible non-unitary |
---|
2370 | multipliers) is fixed. For example, the sum of site fractions for atoms on the |
---|
2371 | same site could be fixed to unity. If selected, a dialog box will appear with a |
---|
2372 | list of the available parameters. Select one and press OK; a second dialog box |
---|
2373 | will appear with only those parameters that can be used in a constraint with |
---|
2374 | the first one. Choose those and press OK. Cancel in either dialog will cancel |
---|
2375 | the operation. The equivalenced parameters will show as an equation of the form |
---|
2376 | M<sub>1</sub>*P<sub>1</sub>+M<sub>2</sub>*P<sub>2</sub>+…=C; the |
---|
2377 | multipliers M1, <span class=GramE>M2, …</span> and C can be changed via |
---|
2378 | the ‘Edit’ button. The keyword ‘CONSTR’ marks it as a |
---|
2379 | constraint. A Delete button can be used to remove it.<o:p></o:p></span></p> |
---|
2380 | |
---|
2381 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
2382 | text-indent:-.25in;mso-list:l17 level2 lfo3'><![if !supportLists]><span |
---|
2383 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
2384 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2385 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Add |
---|
2386 | function</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2387 | – this is very similar the “Add constraint” type except that |
---|
2388 | the result of the sum can be varied in the refinement. The keyword |
---|
2389 | ‘FUNCT’ marks it as a function; the ‘Refine?’ box |
---|
2390 | indicates your choice to refine the result of the sum. A Delete button can be |
---|
2391 | used to remove it.<o:p></o:p></span></p> |
---|
2392 | |
---|
2393 | <h4><a name=Restraints><span style='mso-fareast-font-family:"Times New Roman"'>Restraints</span></a><span |
---|
2394 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
2395 | |
---|
2396 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2397 | window is empty<o:p></o:p></span></p> |
---|
2398 | |
---|
2399 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2400 | |
---|
2401 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Nothing |
---|
2402 | just yet<o:p></o:p></span></p> |
---|
2403 | |
---|
2404 | <h4><a name=Sequential></a><u><span style='mso-fareast-font-family:"Times New Roman"'>Sequential</span></u><span |
---|
2405 | style='mso-fareast-font-family:"Times New Roman"'> refinement results<o:p></o:p></span></h4> |
---|
2406 | |
---|
2407 | <p class=MsoNormal>In this window is tabulated the results of your sequential |
---|
2408 | refinement. The columns are the parameter names; the naming convention is |
---|
2409 | ‘p<span class=GramE>:h:name:n’</span> where p is the phase number, |
---|
2410 | h is the histogram number, name is the parameter name, and num (if needed) is |
---|
2411 | the item number (e.g. atom number). The rows are the data sets used in the |
---|
2412 | sequential refinement.</p> |
---|
2413 | |
---|
2414 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2415 | |
---|
2416 | <h5><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></h5> |
---|
2417 | |
---|
2418 | <h3>Histograms</h3> |
---|
2419 | |
---|
2420 | <p class=MsoNormal>These are shown in the data tree with a prefix of |
---|
2421 | ‘PWDR’, ’HKLF’, ‘IMG’, ‘PDF’ or |
---|
2422 | ‘XXXX’ (future – restraints??) and usually a file name. These |
---|
2423 | constitute the data sets (‘Histograms’) to be used by GSAS-II for |
---|
2424 | analysis. Selection of these items does not produce any information in the data |
---|
2425 | window but does display the data in the Plots Window. They are described below.</p> |
---|
2426 | |
---|
2427 | <h3><a name="PWD_Analysis"></a>Powder Histograms - PWDR</h3> |
---|
2428 | |
---|
2429 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>When |
---|
2430 | a powder diffraction data set (prefix ‘PWDR’) is selected from the </span><a |
---|
2431 | href="#Data_tree"><span style='mso-fareast-font-family:"Times New Roman"'>data |
---|
2432 | tree</span></a><span style='mso-fareast-font-family:"Times New Roman"'>, a variety |
---|
2433 | of subcategories in the tree are shown. The items that are shown depend on the |
---|
2434 | data set type. Selecting a subcategory raises the window listed below. <o:p></o:p></span></p> |
---|
2435 | |
---|
2436 | <h5><a name=Comments></a><a name=""></a><span style='mso-bookmark:Comments'><span |
---|
2437 | style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></span></h5> |
---|
2438 | |
---|
2439 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l20 level1 lfo4'><span |
---|
2440 | style='mso-bookmark:Comments'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2441 | "Times New Roman"'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
---|
2442 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>Menu |
---|
2443 | ‘<b style='mso-bidi-font-weight:normal'>Analysis</b>’ – <o:p></o:p></span></span></p> |
---|
2444 | |
---|
2445 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
2446 | text-indent:-.25in;mso-list:l18 level1 lfo5'><span style='mso-bookmark:Comments'><![if !supportLists]><span |
---|
2447 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2448 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2449 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Analyze</span></b></span><span |
---|
2450 | style='mso-bookmark:Comments'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2451 | – this produces a ‘normal probability’ plot for the |
---|
2452 | refinement result as bounded by the limits. The slope and intercept of the |
---|
2453 | curve in the central region (-1 < </span></span><span style='mso-bookmark: |
---|
2454 | Comments'><span style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>D</span></span><span |
---|
2455 | style='mso-bookmark:Comments'><span style='mso-fareast-font-family:"Times New Roman"'>/</span></span><span |
---|
2456 | style='mso-bookmark:Comments'><span style='font-family:Symbol;mso-fareast-font-family: |
---|
2457 | "Times New Roman"'>s</span></span><span style='mso-bookmark:Comments'><span |
---|
2458 | style='mso-fareast-font-family:"Times New Roman"'> < 1) are shown on the |
---|
2459 | plot status line. The slope is the square root of GOF for the best fit set of |
---|
2460 | data points (~68% of the data).<o:p></o:p></span></span></p> |
---|
2461 | |
---|
2462 | <h4><span style='mso-bookmark:Comments'><u>Comments<o:p></o:p></u></span></h4> |
---|
2463 | |
---|
2464 | <p class=MsoNormal><span style='mso-bookmark:Comments'>This window shows |
---|
2465 | whatever comment lines (preceded by “#”) found when the powder data |
---|
2466 | file was read by GSAS-II. If you are lucky, there will be useful information |
---|
2467 | here (e.g. sample name, date collected, wavelength used, etc.). If not, this window |
---|
2468 | will be blank. The text is read-only in that anything you try to enter here is |
---|
2469 | not saved.</span></p> |
---|
2470 | |
---|
2471 | <span style='mso-bookmark:Comments'></span> |
---|
2472 | |
---|
2473 | <h4><a name=Limits><u><span style='mso-fareast-font-family:"Times New Roman"'>Limits</span></u></a><u><span |
---|
2474 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></h4> |
---|
2475 | |
---|
2476 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2477 | window shows the limits in position to be used in any fitting for this powder |
---|
2478 | pattern. The ‘original’ values are obtained from the minimum & |
---|
2479 | maximum values in the powder pattern. You can modify ‘changed’ as |
---|
2480 | needed.<o:p></o:p></span></p> |
---|
2481 | |
---|
2482 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2483 | |
---|
2484 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
---|
2485 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2486 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2487 | style='mso-fareast-font-family:"Times New Roman"'>You can change <span |
---|
2488 | class=SpellE>Tmin</span> and <span class=SpellE>Tmax</span> in the |
---|
2489 | ‘changed’ row as needed. Use the mouse to select the value to be |
---|
2490 | changed (the background on the box will be blue or have a black border or a |
---|
2491 | vertical bar will appear in the value), then enter the new value and press |
---|
2492 | Enter or click the mouse elsewhere in the Background window. This will set the |
---|
2493 | new value.<o:p></o:p></span></p> |
---|
2494 | |
---|
2495 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
---|
2496 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2497 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2498 | style='mso-fareast-font-family:"Times New Roman"'>Modify the values of |
---|
2499 | ‘changed’; this can be done on the plot by dragging the limit bars |
---|
2500 | (left – vertical green dashed line, right – vertical red dashed |
---|
2501 | line) into position. A left or right mouse click on a data point on the plot |
---|
2502 | will set the associated limit. In either case the appropriate value on the |
---|
2503 | ‘changed’ row will be updated immediately.<o:p></o:p></span></p> |
---|
2504 | |
---|
2505 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l3 level1 lfo6'><![if !supportLists]><span |
---|
2506 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2507 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2508 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
2509 | style='mso-bidi-font-weight:normal'>File</b>’ – <o:p></o:p></span></p> |
---|
2510 | |
---|
2511 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
2512 | text-indent:-.25in;mso-list:l3 level2 lfo6;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2513 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2514 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2515 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
---|
2516 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
---|
2517 | limits shown to other selected powder patterns. If used, a dialog box (Copy |
---|
2518 | Parameters) will appear showing the list of available powder patterns, you can |
---|
2519 | copy the limits parameters to any or all of them; select ‘All’ to |
---|
2520 | copy them to all patterns. Then select ‘OK’ to do the copy; |
---|
2521 | ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
---|
2522 | |
---|
2523 | <h4><a name=Background><u><span style='mso-fareast-font-family:"Times New Roman"'>Background<o:p></o:p></span></u></a></h4> |
---|
2524 | |
---|
2525 | <span style='mso-bookmark:Background'></span> |
---|
2526 | |
---|
2527 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2528 | window shows the choice of background functions and coefficients to be used in |
---|
2529 | fitting this powder pattern. There are three types of contributions available |
---|
2530 | for the background:<o:p></o:p></span></p> |
---|
2531 | |
---|
2532 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>1). |
---|
2533 | A continuous empirical function (‘<span class=SpellE>chebyschev</span>’, |
---|
2534 | ‘cosine’, ‘<span class=SpellE><span class=GramE>lin</span></span> |
---|
2535 | interpolate’, ‘inv interpolate’ & ‘log |
---|
2536 | interpolate’). The latter three select fixed points with spacing that is <span |
---|
2537 | class=GramE>either equal</span>, inversely equal or equal on a log scale of the |
---|
2538 | x-coordinate. The set of magnitudes at each point then comprise the background |
---|
2539 | variables. All are refined when refine is selected.<o:p></o:p></span></p> |
---|
2540 | |
---|
2541 | <p class=MsoNormal style='tab-stops:0in'><span style='mso-fareast-font-family: |
---|
2542 | "Times New Roman"'>2). A set of Debye diffuse scattering equation terms of the |
---|
2543 | form:<o:p></o:p></span></p> |
---|
2544 | |
---|
2545 | <p class=MsoNormal style='tab-stops:0in'><span style='mso-fareast-font-family: |
---|
2546 | "Times New Roman"'><span style='mso-tab-count:1'> </span></span><!--[if gte msEquation 12]><m:oMath><i |
---|
2547 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
2548 | mso-fareast-font-family:"Times New Roman"'><span style='mso-tab-count:3'> </span><m:r>B</m:r><m:r>=</m:r><m:r>A</m:r></span></i><m:d><m:dPr><span |
---|
2549 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
2550 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
2551 | normal'><m:ctrlPr></m:ctrlPr></span></m:dPr><m:e><m:f><m:fPr><m:type m:val="skw"/><span |
---|
2552 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
2553 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
2554 | normal'><m:ctrlPr></m:ctrlPr></span></m:fPr><m:num><i style='mso-bidi-font-style: |
---|
2555 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
2556 | "Times New Roman"'><m:r>sinQR</m:r></span></i></m:num><m:den><i |
---|
2557 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
2558 | mso-fareast-font-family:"Times New Roman"'><m:r>QR</m:r></span></i></m:den></m:f></m:e></m:d><m:sSup><m:sSupPr><span |
---|
2559 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
2560 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
2561 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
2562 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
2563 | "Times New Roman"'><m:r>e</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
---|
2564 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
2565 | "Times New Roman"'><m:r>-</m:r><m:r>U</m:r></span></i><m:sSup><m:sSupPr><span |
---|
2566 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
2567 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
2568 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
2569 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
2570 | "Times New Roman"'><m:r>Q</m:r></span></i></m:e><m:sup><i |
---|
2571 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
2572 | mso-fareast-font-family:"Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup></m:sup></m:sSup></m:oMath><![endif]--><![if !msEquation]><span |
---|
2573 | style='font-size:12.0pt;font-family:"Times New Roman","serif";mso-fareast-font-family: |
---|
2574 | "Times New Roman";mso-fareast-theme-font:minor-fareast;position:relative; |
---|
2575 | top:16.0pt;mso-text-raise:-16.0pt;mso-ansi-language:EN-US;mso-fareast-language: |
---|
2576 | EN-US;mso-bidi-language:AR-SA'><!--[if gte vml 1]><v:shape id="_x0000_i1025" |
---|
2577 | type="#_x0000_t75" style='width:133.5pt;height:38.25pt'> |
---|
2578 | <v:imagedata src="gsasII_files/image001.png" o:title="" chromakey="white"/> |
---|
2579 | </v:shape><![endif]--><![if !vml]><img width=178 height=51 |
---|
2580 | src="gsasII_files/image002.gif" v:shapes="_x0000_i1025"><![endif]></span><![endif]><span |
---|
2581 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-tab-count: |
---|
2582 | 1'> </span><o:p></o:p></span></p> |
---|
2583 | |
---|
2584 | <p class=MsoNormal><span class=GramE><span style='mso-fareast-font-family:"Times New Roman"'>where</span></span><span |
---|
2585 | style='mso-fareast-font-family:"Times New Roman"'> A,R & U are the possible |
---|
2586 | variables and can be individually selected as desired; Q = 2</span><span |
---|
2587 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>p</span><span |
---|
2588 | style='mso-fareast-font-family:"Times New Roman"'>/d.<o:p></o:p></span></p> |
---|
2589 | |
---|
2590 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>3). |
---|
2591 | A set of individual Bragg peaks using the pseudo-Voigt profile function as |
---|
2592 | their shapes. Their parameters are ‘<span class=SpellE>pos</span>’, |
---|
2593 | ’<span class=SpellE>int</span>’, ‘sig’ & |
---|
2594 | ‘gam’; each can be selected for refinement. The default values for |
---|
2595 | sig & gam (=0.10) are for very sharp peaks, you may adjust them accordingly |
---|
2596 | to the kind of peak you are trying to fit before trying to refine them.<o:p></o:p></span></p> |
---|
2597 | |
---|
2598 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2599 | |
---|
2600 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2601 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2602 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2603 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
2604 | style='mso-bidi-font-weight:normal'>File</b>’ – <o:p></o:p></span></p> |
---|
2605 | |
---|
2606 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2607 | auto;text-indent:-.25in;mso-list:l2 level1 lfo8'><![if !supportLists]><span |
---|
2608 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2609 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2610 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
---|
2611 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
---|
2612 | background parameters shown to other selected powder patterns. If used, a |
---|
2613 | dialog box (Copy Parameters) will appear showing the list of available powder |
---|
2614 | patterns, you can copy the background parameters to any or all of them; select |
---|
2615 | ‘All’ to copy them to all patterns. Then select ‘OK’ to |
---|
2616 | do the copy; ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
---|
2617 | |
---|
2618 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2619 | auto;text-indent:-.25in;mso-list:l2 level1 lfo8'><![if !supportLists]><span |
---|
2620 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2621 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2622 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
---|
2623 | flags </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
---|
2624 | this copies only the refinement flags shown to other selected powder patterns. |
---|
2625 | If used, a dialog box (Copy Refinement Flags) will appear showing the list of available |
---|
2626 | powder patterns, you can copy the refinement flags to any or all of them; |
---|
2627 | select ‘All’ to copy them to all patterns. Then select |
---|
2628 | ‘OK’ to do the copy; ‘Cancel’ to cancel the operation.<o:p></o:p></span></p> |
---|
2629 | |
---|
2630 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2631 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2632 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2633 | style='mso-fareast-font-family:"Times New Roman"'>You can select a different |
---|
2634 | Background function from the pull down tab.<o:p></o:p></span></p> |
---|
2635 | |
---|
2636 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2637 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2638 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2639 | style='mso-fareast-font-family:"Times New Roman"'>You can choose to refine/not |
---|
2640 | refine the background coefficients.<o:p></o:p></span></p> |
---|
2641 | |
---|
2642 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2643 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
2644 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2645 | style='mso-fareast-font-family:"Times New Roman"'>You can select the number of |
---|
2646 | background coefficients to be used (1-36).<o:p></o:p></span></p> |
---|
2647 | |
---|
2648 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2649 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
2650 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2651 | style='mso-fareast-font-family:"Times New Roman"'>You can change individual |
---|
2652 | background coefficient values. Enter the value then press Enter or click the |
---|
2653 | mouse elsewhere in the Background window. This will set the new value.<o:p></o:p></span></p> |
---|
2654 | |
---|
2655 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2656 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>6.<span |
---|
2657 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2658 | style='mso-fareast-font-family:"Times New Roman"'>You can introduce one or more |
---|
2659 | Debye scattering terms into the background. For each one you should enter a |
---|
2660 | sensible value for ‘R’ – an expected interatomic distance in |
---|
2661 | an amorphous phase is appropriate. Select parameters to refine; usually start |
---|
2662 | with the ‘A’ coefficients.<o:p></o:p></span></p> |
---|
2663 | |
---|
2664 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l19 level1 lfo7'><![if !supportLists]><span |
---|
2665 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>7.<span |
---|
2666 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2667 | style='mso-fareast-font-family:"Times New Roman"'>You can introduce single |
---|
2668 | Bragg peaks into the background. For each you should specify at least the |
---|
2669 | position. Select parameters to refine; usually start with the ‘<span |
---|
2670 | class=SpellE>int</span>’ coefficients.<o:p></o:p></span></p> |
---|
2671 | |
---|
2672 | <h4><a name="Instrument_Parameters"><u><span style='mso-fareast-font-family: |
---|
2673 | "Times New Roman"'>Instrument Parameters</span></u></a><u><span |
---|
2674 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></h4> |
---|
2675 | |
---|
2676 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2677 | window shows the instrument parameters for the selected powder data set. <o:p></o:p></span></p> |
---|
2678 | |
---|
2679 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
2680 | |
---|
2681 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
---|
2682 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
2683 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2684 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
2685 | style='mso-bidi-font-weight:normal'>Operations</b>’ –<o:p></o:p></span></p> |
---|
2686 | |
---|
2687 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2688 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2689 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2690 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2691 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Load |
---|
2692 | profile… </span></b><span style='mso-fareast-font-family:"Times New Roman"'>- |
---|
2693 | loads a GSAS-II instrument parameter file (<span class=SpellE>name.instprm</span>), |
---|
2694 | replacing the existing instrument parameter values. All refinement flags are |
---|
2695 | unset.<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
---|
2696 | |
---|
2697 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2698 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2699 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2700 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2701 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Save |
---|
2702 | profile… - </span></b><span style='mso-fareast-font-family:"Times New Roman"'>saves |
---|
2703 | the current instrument parameter values in a simple text file (<span |
---|
2704 | class=SpellE>name.instprm</span>); you will be prompted for the file name |
---|
2705 | – do not change the extension. This file may be edited but heed the warning |
---|
2706 | to not change the parameter names, the order of the parameter records or add |
---|
2707 | new parameter records as this will invalidate the file. You may only change the |
---|
2708 | numeric values if necessary. You can change or add comment records (begins with |
---|
2709 | ‘#’).<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
---|
2710 | |
---|
2711 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2712 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2713 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
2714 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2715 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Reset |
---|
2716 | profile </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
---|
2717 | resets the values for the instrument parameters to the default values shown in |
---|
2718 | parentheses for each entry.<b style='mso-bidi-font-weight:normal'><o:p></o:p></b></span></p> |
---|
2719 | |
---|
2720 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2721 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2722 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
2723 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2724 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b><span |
---|
2725 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
---|
2726 | instrument parameters shown to other selected powder patterns. If used, a |
---|
2727 | dialog box (Copy parameters) will appear showing the list of available powder |
---|
2728 | patterns, you can copy the instrument parameters to any or all of them; select |
---|
2729 | ‘All’ to copy them to all patterns. Then select ‘OK’ to |
---|
2730 | do the copy; ‘Cancel’ to cancel the operation. The copy will only |
---|
2731 | work for instrument parameters that are commensurate with the one that is |
---|
2732 | shown, e.g. single radiation patterns will not be updated from K</span><sub><span |
---|
2733 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2734 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
---|
2735 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
---|
2736 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2737 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
---|
2738 | style='mso-fareast-font-family:"Times New Roman"'> ones.<o:p></o:p></span></p> |
---|
2739 | |
---|
2740 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2741 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2742 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
2743 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2744 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
---|
2745 | flags </span></b><span style='mso-fareast-font-family:"Times New Roman"'>- |
---|
2746 | – this copies the instrument parameter refinement flags shown to other selected |
---|
2747 | powder patterns. If used, a dialog box (Copy refinement flags) will appear |
---|
2748 | showing the list of available powder patterns, you can copy the instrument |
---|
2749 | parameter refinement flags to any or all of them; select ‘All’ to |
---|
2750 | copy them to all patterns. Then select ‘OK’ to do the copy; |
---|
2751 | ‘Cancel’ to cancel the operation. The copy will only work for |
---|
2752 | instrument parameters that are commensurate with the one that is shown, e.g. |
---|
2753 | single radiation patterns will not be updated from K</span><sub><span |
---|
2754 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2755 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
---|
2756 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
---|
2757 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2758 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
---|
2759 | style='mso-fareast-font-family:"Times New Roman"'> ones.<o:p></o:p></span></p> |
---|
2760 | |
---|
2761 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
2762 | auto;text-indent:-.25in;mso-list:l16 level2 lfo10;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
2763 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
2764 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2765 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Change |
---|
2766 | radiation</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2767 | – this changes the radiation between single wavelength (e.g. for |
---|
2768 | synchrotron source) and K</span><sub><span style='font-family:Symbol; |
---|
2769 | mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2770 | style='mso-fareast-font-family:"Times New Roman"'>1</span></sub><span |
---|
2771 | style='mso-fareast-font-family:"Times New Roman"'>/K</span><sub><span |
---|
2772 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>a</span></sub><sub><span |
---|
2773 | style='mso-fareast-font-family:"Times New Roman"'>2</span></sub><span |
---|
2774 | style='mso-fareast-font-family:"Times New Roman"'> wavelength pairs (e.g. a |
---|
2775 | laboratory tube source).<o:p></o:p></span></p> |
---|
2776 | |
---|
2777 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
---|
2778 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
2779 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2780 | style='mso-fareast-font-family:"Times New Roman"'>You can change any of the |
---|
2781 | profile coefficients<o:p></o:p></span></p> |
---|
2782 | |
---|
2783 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l8 level1 lfo9'><![if !supportLists]><span |
---|
2784 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
2785 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2786 | style='mso-fareast-font-family:"Times New Roman"'>You can choose to refine any |
---|
2787 | profile coefficients. <b style='mso-bidi-font-weight:normal'>NB</b>: In certain |
---|
2788 | circumstances some choices are ignored e.g. Zero is not refined during peak |
---|
2789 | fitting. Also some choices may lead to unstable refinement, e.g. <span |
---|
2790 | class=GramE>Lam</span> refinement and lattice parameter refinement. Examine the |
---|
2791 | ‘</span><a href="#Covariance"><span style='mso-fareast-font-family:"Times New Roman"'>Covariance’</span></a><span |
---|
2792 | style='mso-fareast-font-family:"Times New Roman"'> display for highly |
---|
2793 | correlated parameters.<o:p></o:p></span></p> |
---|
2794 | |
---|
2795 | <h4><a name="Sample_Parameters"></a><u><span style='mso-fareast-font-family: |
---|
2796 | "Times New Roman"'>Sample Parameters<o:p></o:p></span></u></h4> |
---|
2797 | |
---|
2798 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2799 | window show the various sample dependent parameters for this powder pattern. |
---|
2800 | The presence of a refine button indicates which can be refined while others are |
---|
2801 | fixed. All values can be changed in this window.<o:p></o:p></span></p> |
---|
2802 | |
---|
2803 | <h5><a name="Peak_List"></a><a name="Powder_Peaks"><span style='mso-bookmark: |
---|
2804 | Peak_List'><span style='mso-fareast-font-family:"Times New Roman"'>What can I |
---|
2805 | do here?</span></span></a><span style='mso-bookmark:Powder_Peaks'><span |
---|
2806 | style='mso-bookmark:Peak_List'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2807 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'><o:p></o:p></span></span></span></h5> |
---|
2808 | |
---|
2809 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l6 level1 lfo11'><span |
---|
2810 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><![if !supportLists]><span |
---|
2811 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2812 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>1.<span |
---|
2813 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2814 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2815 | normal;mso-bidi-font-weight:bold'>Menu ‘</span></span></span><span |
---|
2816 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><span |
---|
2817 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>File’</span></span></span><span |
---|
2818 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><span |
---|
2819 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2820 | normal;mso-bidi-font-weight:bold'> – <o:p></o:p></span></span></span></h5> |
---|
2821 | |
---|
2822 | <p class=MsoListParagraphCxSpFirst style='margin-left:1.0in;mso-add-space:auto; |
---|
2823 | text-indent:-.25in;mso-list:l6 level2 lfo11;tab-stops:list 1.0in'><span |
---|
2824 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><![if !supportLists]><span |
---|
2825 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
2826 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2827 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy</span></b></span></span><span |
---|
2828 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><span |
---|
2829 | style='mso-fareast-font-family:"Times New Roman"'> – this copies the |
---|
2830 | sample parameters shown to other selected powder patterns. If used, a dialog |
---|
2831 | box (Copy parameters) will appear showing the list of available powder |
---|
2832 | patterns, you can copy the sample parameters to any or all of them; select |
---|
2833 | ‘All’ to copy them to all patterns. Then select ‘OK’ to |
---|
2834 | do the copy; ‘Cancel’ to cancel the operation. <o:p></o:p></span></span></span></p> |
---|
2835 | |
---|
2836 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
2837 | text-indent:-.25in;mso-list:l6 level2 lfo11;tab-stops:list 1.0in'><span |
---|
2838 | style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><![if !supportLists]><span |
---|
2839 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
2840 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
2841 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Copy |
---|
2842 | flags</span></b></span></span><span style='mso-bookmark:Powder_Peaks'><span |
---|
2843 | style='mso-bookmark:Peak_List'><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
2844 | - – this copies the sample parameter refinement flags shown to other |
---|
2845 | selected powder patterns. If used, a dialog box (Copy refinement flags) will |
---|
2846 | appear showing the list of available powder patterns, you can copy the sample |
---|
2847 | parameter refinement flags to any or all of them; select ‘All’ to |
---|
2848 | copy them to all patterns. Then select ‘OK’ to do the copy; |
---|
2849 | ‘Cancel’ to cancel the operation. <o:p></o:p></span></span></span></p> |
---|
2850 | |
---|
2851 | <h4><span style='mso-bookmark:Powder_Peaks'><span style='mso-bookmark:Peak_List'><span |
---|
2852 | style='mso-fareast-font-family:"Times New Roman"'>Peak List</span></span></span><span |
---|
2853 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
2854 | |
---|
2855 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
2856 | window shows the list of peaks that will be used by the peak fitting |
---|
2857 | refinement. It is filled by picking peaks in the powder pattern displayed in |
---|
2858 | the GSASII Plots window as a sequence of ‘+’ marks.<o:p></o:p></span></p> |
---|
2859 | |
---|
2860 | <h5><a name="Index_Peaks"></a><a name="Index_Peak_List"></a><span |
---|
2861 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'>What |
---|
2862 | can I do here? </span></span><span style='mso-bookmark:Index_Peaks'><span |
---|
2863 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2864 | normal;mso-bidi-font-weight:bold'><o:p></o:p></span></span></h5> |
---|
2865 | |
---|
2866 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2867 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2868 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
---|
2869 | bold'><span style='mso-list:Ignore'>1.<span style='font:7.0pt "Times New Roman"'> |
---|
2870 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2871 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>Menu ‘</span></span><span |
---|
2872 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2873 | color:windowtext'>Peak Fitting</span></span><span style='mso-bookmark:Index_Peaks'><span |
---|
2874 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2875 | normal;mso-bidi-font-weight:bold'>’ – <o:p></o:p></span></span></h5> |
---|
2876 | |
---|
2877 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
---|
2878 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
---|
2879 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2880 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>a.<span |
---|
2881 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2882 | class=SpellE><span style='mso-fareast-font-family:"Times New Roman";color:windowtext'>UnDo</span></span></span><span |
---|
2883 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2884 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'> – resets |
---|
2885 | peak parameters, background and instrument parameter values varied in the last |
---|
2886 | peak fitting refinement back to their original values. Use this to recover from |
---|
2887 | a failed refinement. Note:<span style='mso-spacerun:yes'> </span>there is |
---|
2888 | only a single level of recovery available.<o:p></o:p></span></span></h5> |
---|
2889 | |
---|
2890 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
---|
2891 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
---|
2892 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2893 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>b.<span |
---|
2894 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2895 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>LSQ <span |
---|
2896 | class=SpellE>PeakFit</span></span></span><span style='mso-bookmark:Index_Peaks'><span |
---|
2897 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2898 | normal;mso-bidi-font-weight:bold'> – perform a least squares fit of the |
---|
2899 | peaks in <span class=SpellE>PeakList</span> to the data. Any peak parameters, |
---|
2900 | background parameters and instrument parameters with refine checked will be |
---|
2901 | varied in this refinement. The refinement will proceed until convergence. We |
---|
2902 | suggest you vary the intensity along with the background first (the default), |
---|
2903 | then vary the position and instrument parameters after. The order will depend |
---|
2904 | on how poor is the initial estimate of the instrument parameters (U, V, W, X, Y |
---|
2905 | & SH/L). To determine how to proceed, examine in detail the powder pattern |
---|
2906 | difference curve displayed in the GSASII Plots window. If individual peaks show |
---|
2907 | peak widths that are widely different, their individual sigma and gamma |
---|
2908 | parameters may be refined. If the refinement results in negative peak |
---|
2909 | coefficients, these will be highlighted in red. If this happens, you should </span></span><span |
---|
2910 | style='mso-bookmark:Index_Peaks'><span class=SpellE><span style='mso-fareast-font-family: |
---|
2911 | "Times New Roman";color:windowtext'>UnDo</span></span></span><span |
---|
2912 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2913 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'> the refinement |
---|
2914 | and reconsider your choice of parameters to be varied.<o:p></o:p></span></span></h5> |
---|
2915 | |
---|
2916 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
---|
2917 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
---|
2918 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2919 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>c.<span |
---|
2920 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2921 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>LSQ one |
---|
2922 | cycle </span></span><span style='mso-bookmark:Index_Peaks'><span |
---|
2923 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2924 | normal;mso-bidi-font-weight:bold'>– perform a single cycle of least |
---|
2925 | squares refinement. This can be used in difficult cases to get a refinement |
---|
2926 | started toward convergence.<o:p></o:p></span></span></h5> |
---|
2927 | |
---|
2928 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
---|
2929 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
---|
2930 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2931 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>d.<span |
---|
2932 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2933 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>Reset sig |
---|
2934 | and gam </span></span><span style='mso-bookmark:Index_Peaks'><span |
---|
2935 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2936 | normal;mso-bidi-font-weight:bold'>– this resets the values of sigma and |
---|
2937 | gamma to those computed from the instrument parameters U, V, W, <span |
---|
2938 | class=GramE>X</span> & Y.<o:p></o:p></span></span></h5> |
---|
2939 | |
---|
2940 | <h5 style='margin-left:1.0in;text-indent:-.25in;mso-list:l9 level2 lfo12; |
---|
2941 | tab-stops:list 1.0in'><span style='mso-bookmark:Index_Peaks'><![if !supportLists]><span |
---|
2942 | style='mso-fareast-font-family:"Times New Roman";color:windowtext;font-weight: |
---|
2943 | normal;mso-bidi-font-weight:bold'><span style='mso-list:Ignore'>e.<span |
---|
2944 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
2945 | style='mso-fareast-font-family:"Times New Roman";color:windowtext'>Clear peaks </span></span><span |
---|
2946 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2947 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>– this |
---|
2948 | removes all the peaks from the Peak List.<o:p></o:p></span></span></h5> |
---|
2949 | |
---|
2950 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2951 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2952 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
---|
2953 | bold'><span style='mso-list:Ignore'>2.<span style='font:7.0pt "Times New Roman"'> |
---|
2954 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2955 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can add |
---|
2956 | peaks to the Peak list using the mouse on the plot by: 1) position the pointer |
---|
2957 | near to the top point on a peak, 2) press the left mouse button. The selected |
---|
2958 | peak will be added to the Peak List in its correct sorted order and a blue |
---|
2959 | vertical line will be plotted on that position. Be sure that the Zoom/Pan |
---|
2960 | buttons are not selected on the Plot window. We recommend that you begin |
---|
2961 | picking peaks from the right side of the pattern; that way the tool tip |
---|
2962 | won’t be in your way as you select peaks.<o:p></o:p></span></span></h5> |
---|
2963 | |
---|
2964 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2965 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2966 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
---|
2967 | bold'><span style='mso-list:Ignore'>3.<span style='font:7.0pt "Times New Roman"'> |
---|
2968 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2969 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can move a |
---|
2970 | Peak List item using the mouse on the plot by: 1) position the pointer on the |
---|
2971 | blue line for the peak you wish to move, 2) holding the left mouse button down, |
---|
2972 | drag to the desired position & then release the button. The peak line will |
---|
2973 | be drawn in the new position. Be sure that the Zoom/Pan buttons are not |
---|
2974 | selected on the Plot window.<o:p></o:p></span></span></h5> |
---|
2975 | |
---|
2976 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2977 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2978 | "Times New Roman"'><span style='mso-list:Ignore'>4.<span style='font:7.0pt "Times New Roman"'> |
---|
2979 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"'>You |
---|
2980 | can change individual peak coefficient values. Enter the value then press Enter |
---|
2981 | or Tab or click the mouse elsewhere in the Peak List window. This will set the |
---|
2982 | new value.<o:p></o:p></span></span></p> |
---|
2983 | |
---|
2984 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2985 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2986 | "Times New Roman"'><span style='mso-list:Ignore'>5.<span style='font:7.0pt "Times New Roman"'> |
---|
2987 | </span></span></span><![endif]>You can change the refine flags either by |
---|
2988 | clicking on the box or by selecting one and then selecting the column (a single |
---|
2989 | click on the column heading; column should show in blue). Then type |
---|
2990 | ‘y’ to set the refine flags or ‘n’ to clear the flags. </span><span |
---|
2991 | style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></span></p> |
---|
2992 | |
---|
2993 | <h5 style='margin-left:.5in;text-indent:-.25in;mso-list:l9 level1 lfo12'><span |
---|
2994 | style='mso-bookmark:Index_Peaks'><![if !supportLists]><span style='mso-fareast-font-family: |
---|
2995 | "Times New Roman";color:windowtext;font-weight:normal;mso-bidi-font-weight: |
---|
2996 | bold'><span style='mso-list:Ignore'>6.<span style='font:7.0pt "Times New Roman"'> |
---|
2997 | </span></span></span><![endif]><span style='mso-fareast-font-family:"Times New Roman"; |
---|
2998 | color:windowtext;font-weight:normal;mso-bidi-font-weight:bold'>You can delete |
---|
2999 | peaks in the Peak List by selecting rows (should appear in blue) and then |
---|
3000 | pressing the Delete key. You can also delete peaks using the mouse on the plot |
---|
3001 | by positioning the pointer on the blue line for the peak to be deleted and then |
---|
3002 | pressing the right mouse button. The blue line should vanish and the |
---|
3003 | corresponding peak will be removed from the Peak List. Be sure that the |
---|
3004 | Zoom/Pan buttons are not selected on the Plot window.<o:p></o:p></span></span></h5> |
---|
3005 | |
---|
3006 | <h4><span style='mso-bookmark:Index_Peaks'><span style='mso-fareast-font-family: |
---|
3007 | "Times New Roman"'>Index Peak List</span></span><span style='mso-fareast-font-family: |
---|
3008 | "Times New Roman"'><o:p></o:p></span></h4> |
---|
3009 | |
---|
3010 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3011 | window shows the list of peaks that will be used for indexing (see </span><a |
---|
3012 | href="#Unit_Cells_List"><span style='mso-fareast-font-family:"Times New Roman"'>Unit |
---|
3013 | Cells List</span></a><span style='mso-fareast-font-family:"Times New Roman"'>). |
---|
3014 | It must be filled before indexing can proceed. When indexing is completed, this |
---|
3015 | display will show the resulting <span class=SpellE>hkl</span> values for every |
---|
3016 | indexed reflection along with the calculated d-spacing (‘d-<span |
---|
3017 | class=SpellE>calc</span>’) for the selected unit cell in </span><a |
---|
3018 | href="#Unit_Cells_List"><span style='mso-fareast-font-family:"Times New Roman"'>Unit |
---|
3019 | Cells List</span></a><span style='mso-fareast-font-family:"Times New Roman"'>.<o:p></o:p></span></p> |
---|
3020 | |
---|
3021 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3022 | |
---|
3023 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l21 level1 lfo13'><![if !supportLists]><span |
---|
3024 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3025 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3026 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
3027 | style='mso-bidi-font-weight:normal'>Operations</b>’ – <b |
---|
3028 | style='mso-bidi-font-weight:normal'>Load/Reload</b> – loads the peak |
---|
3029 | positions & intensities from the </span><a href="#Peak_List"><span |
---|
3030 | style='mso-fareast-font-family:"Times New Roman"'>Peak List</span></a><span |
---|
3031 | style='mso-fareast-font-family:"Times New Roman"'> to make them available for |
---|
3032 | the indexing routine. The d-<span class=SpellE>obs</span> is obtained from |
---|
3033 | Bragg’s Law after applying the Zero correction shown on the </span><a |
---|
3034 | href="#Instrument_Parameters"><span style='mso-fareast-font-family:"Times New Roman"'>Instrument |
---|
3035 | Parameters</span></a><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
3036 | table to the position shown here.<o:p></o:p></span></p> |
---|
3037 | |
---|
3038 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l21 level1 lfo13'><![if !supportLists]><span |
---|
3039 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3040 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3041 | style='mso-fareast-font-family:"Times New Roman"'>You may deselect individual |
---|
3042 | peaks from indexing by unchecking the corresponding ‘use’ box.<o:p></o:p></span></p> |
---|
3043 | |
---|
3044 | <h4><a name="Cell_Indexing_Refine"></a><a name="Unit_Cells_List"></a><span |
---|
3045 | style='mso-bookmark:Cell_Indexing_Refine'><span style='mso-fareast-font-family: |
---|
3046 | "Times New Roman"'>Unit Cells List</span></span><span style='mso-fareast-font-family: |
---|
3047 | "Times New Roman"'><o:p></o:p></span></h4> |
---|
3048 | |
---|
3049 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3050 | window... <o:p></o:p></span></p> |
---|
3051 | |
---|
3052 | <h4><a name="Reflection_List"><span style='mso-fareast-font-family:"Times New Roman"'>Reflection |
---|
3053 | List</span></a><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
3054 | |
---|
3055 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3056 | window... <o:p></o:p></span></p> |
---|
3057 | |
---|
3058 | <h3>Single Crystal Histograms - HKLF</h3> |
---|
3059 | |
---|
3060 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>Pair Distribution |
---|
3061 | Functions - PDF<o:p></o:p></span></h3> |
---|
3062 | |
---|
3063 | <h4><a name="PDF_Controls"></a><span style='mso-fareast-font-family:"Times New Roman"'>PDF |
---|
3064 | Controls<o:p></o:p></span></h4> |
---|
3065 | |
---|
3066 | <p class=MsoNormal>This window </p> |
---|
3067 | |
---|
3068 | <h4><a name="I_Q"></a><span class=GramE><span style='mso-fareast-font-family: |
---|
3069 | "Times New Roman"'>I(</span></span><span style='mso-fareast-font-family:"Times New Roman"'>Q), |
---|
3070 | <a name="S_Q"></a>S(Q), <a name="F_Q"></a>F(Q) & <a name="G_R"></a>G(R)<o:p></o:p></span></h4> |
---|
3071 | |
---|
3072 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3073 | window... <o:p></o:p></span></p> |
---|
3074 | |
---|
3075 | <h3><span style='mso-fareast-font-family:"Times New Roman"'>2-D Images – |
---|
3076 | IMG<o:p></o:p></span></h3> |
---|
3077 | |
---|
3078 | <h4><a name=Images>Image Controls</a></h4> |
---|
3079 | |
---|
3080 | <span style='mso-bookmark:Images'></span> |
---|
3081 | |
---|
3082 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3083 | window... <o:p></o:p></span></p> |
---|
3084 | |
---|
3085 | <h4><a name="_Image_Masks"></a><a href="#_Image_Masks"><span style='color:#4F81BD; |
---|
3086 | mso-themecolor:accent1;text-decoration:none;text-underline:none'>Image Ma<span |
---|
3087 | style='mso-bookmark:Image_Masks'></span>sks</span></a><![if !supportNestedAnchors]><a |
---|
3088 | name="Image_Masks"></a><![endif]></h4> |
---|
3089 | |
---|
3090 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3091 | window... <o:p></o:p></span></p> |
---|
3092 | |
---|
3093 | <h3>Phase Windows</h3> |
---|
3094 | |
---|
3095 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>When |
---|
3096 | a phase is selected from the <a href="#Data_tree">data tree</a>, parameters are |
---|
3097 | shown for that selected phase in a tabbed window. Clicking on each tab raises |
---|
3098 | the windows listed below. Each tab is identified by the underlined phrase in |
---|
3099 | the following:<o:p></o:p></span></p> |
---|
3100 | |
---|
3101 | <h4><a name=General></a><a name="_Ref317241833"><span style='mso-bookmark:General'><u>General</u> |
---|
3102 | Phase Parameters</span></a><span style='mso-bookmark:General'></span></h4> |
---|
3103 | |
---|
3104 | <span style='mso-bookmark:General'></span> |
---|
3105 | |
---|
3106 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3107 | gives overall parameters describing the phase such as the name, space group, |
---|
3108 | the unit cell parameters and overall parameters for the atom present in the |
---|
3109 | phase. It also has the controls for computing Fourier maps for this phase.<o:p></o:p></span></p> |
---|
3110 | |
---|
3111 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3112 | |
---|
3113 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
---|
3114 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3115 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3116 | style='mso-fareast-font-family:"Times New Roman"'>Menu ‘<b |
---|
3117 | style='mso-bidi-font-weight:normal'>Compute’</b> – The compute menu |
---|
3118 | shows computations that are possible for this phase.<o:p></o:p></span></p> |
---|
3119 | |
---|
3120 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3121 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3122 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3123 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3124 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Fourier |
---|
3125 | maps</span></b><span style='mso-fareast-font-family:"Times New Roman"'> – |
---|
3126 | compute Fourier maps according to the controls set at bottom of General page.<o:p></o:p></span></p> |
---|
3127 | |
---|
3128 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3129 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3130 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3131 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3132 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Search |
---|
3133 | maps </span></b><span style='mso-fareast-font-family:"Times New Roman"'>– |
---|
3134 | search the computed Fourier map. Peaks that are above ‘Peak cutoff’ |
---|
3135 | % of the maximum will be found in this procedure; they will be printed on the |
---|
3136 | console and will be shown in the ‘<a href="gsasII.html">Map peaks</a>’ |
---|
3137 | page. This page will immediately be shown and the peaks will be shown on the structure |
---|
3138 | drawing for this phase as white 3-D crosses.<o:p></o:p></span></p> |
---|
3139 | |
---|
3140 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
---|
3141 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3142 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3143 | style='mso-fareast-font-family:"Times New Roman"'>The items in the upper part |
---|
3144 | of the General page that can be changed are Phase name, Phase type, Space |
---|
3145 | group, unit cell parameters & refine flag. These are described in turn:<u><o:p></o:p></u></span></p> |
---|
3146 | |
---|
3147 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3148 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3149 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3150 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3151 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Phase |
---|
3152 | name</span></b><span style='mso-fareast-font-family:"Times New Roman"'> – |
---|
3153 | this is the name assigned to this phase. It should only be changed when the |
---|
3154 | phase is initialized or imported.<u><o:p></o:p></u></span></p> |
---|
3155 | |
---|
3156 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3157 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3158 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3159 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3160 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Phase |
---|
3161 | type – </span></b><span style='mso-fareast-font-family:"Times New Roman"'>this |
---|
3162 | can only be set when there are no atoms in the Atoms page for this phase. |
---|
3163 | Select it when the phase is initialized.<u><o:p></o:p></u></span></p> |
---|
3164 | |
---|
3165 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3166 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3167 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
3168 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3169 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Space |
---|
3170 | group</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
3171 | – this should be set when the phase is initialized; it can be changed |
---|
3172 | later. Be careful about the impact on Atom site symmetry and multiplicity if |
---|
3173 | you do. GSAS-II will recognize any legal space group symbol using the short |
---|
3174 | Hermann-<span class=SpellE>Mauguin</span> forms; put a space between the axial |
---|
3175 | fields (e.g. ‘F d 3 m’ not ‘Fd3m’). For space groups |
---|
3176 | with a choice of origin (e.g. F d 3 m), GSAS-II always uses the 2<sup>nd</sup> |
---|
3177 | setting where the center of inversion is located at the origin. The choice of |
---|
3178 | space group will set the available unit cell parameters.<u><o:p></o:p></u></span></p> |
---|
3179 | |
---|
3180 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3181 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3182 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
3183 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3184 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Refine |
---|
3185 | unit cell</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
3186 | – set this flag to refine the unit cell parameters in a Rietveld or |
---|
3187 | Pawley refinement. The actual parameters refined are the symmetry allowed terms |
---|
3188 | (A<sub>0</sub>-A<sub>5</sub>) in the expression</span><i style='mso-bidi-font-style: |
---|
3189 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3190 | "Times New Roman"'><br> |
---|
3191 | </span></i><!--[if gte msEquation 12]><m:oMathPara><m:oMath><m:sSup><m:sSupPr><span |
---|
3192 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3193 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3194 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
3195 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3196 | "Times New Roman"'><m:r>d</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
---|
3197 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3198 | "Times New Roman"'><m:r>*2</m:r></span></i></m:sup></m:sSup><i |
---|
3199 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3200 | mso-fareast-font-family:"Times New Roman"'><m:r>=</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3201 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3202 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3203 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3204 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3205 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3206 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3207 | "Times New Roman"'><m:r>0</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
---|
3208 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3209 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3210 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
3211 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3212 | "Times New Roman"'><m:r>h</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
---|
3213 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3214 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
---|
3215 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3216 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3217 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3218 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3219 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3220 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3221 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3222 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3223 | "Times New Roman"'><m:r>1</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
---|
3224 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3225 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3226 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
3227 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3228 | "Times New Roman"'><m:r>k</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
---|
3229 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3230 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
---|
3231 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3232 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3233 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3234 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3235 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3236 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3237 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3238 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3239 | "Times New Roman"'><m:r>2</m:r></span></i></m:sub></m:sSub><m:sSup><m:sSupPr><span |
---|
3240 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3241 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3242 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSupPr><m:e><i style='mso-bidi-font-style: |
---|
3243 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3244 | "Times New Roman"'><m:r>l</m:r></span></i></m:e><m:sup><i style='mso-bidi-font-style: |
---|
3245 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3246 | "Times New Roman"'><m:r>2</m:r></span></i></m:sup></m:sSup><i |
---|
3247 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3248 | mso-fareast-font-family:"Times New Roman"'><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3249 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3250 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3251 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3252 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3253 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3254 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3255 | "Times New Roman"'><m:r>3</m:r></span></i></m:sub></m:sSub><i |
---|
3256 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3257 | mso-fareast-font-family:"Times New Roman"'><m:r>h</m:r><m:r>k</m:r><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3258 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3259 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3260 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3261 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3262 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3263 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3264 | "Times New Roman"'><m:r>4</m:r></span></i></m:sub></m:sSub><i |
---|
3265 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3266 | mso-fareast-font-family:"Times New Roman"'><m:r>h</m:r><m:r>l</m:r><m:r>+</m:r></span></i><m:sSub><m:sSubPr><span |
---|
3267 | style='font-family:"Cambria Math","serif";mso-ascii-font-family:"Cambria Math"; |
---|
3268 | mso-hansi-font-family:"Cambria Math";font-style:italic;mso-bidi-font-style: |
---|
3269 | normal'><m:ctrlPr></m:ctrlPr></span></m:sSubPr><m:e><i style='mso-bidi-font-style: |
---|
3270 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3271 | "Times New Roman"'><m:r>A</m:r></span></i></m:e><m:sub><i style='mso-bidi-font-style: |
---|
3272 | normal'><span style='font-family:"Cambria Math","serif";mso-fareast-font-family: |
---|
3273 | "Times New Roman"'><m:r>5</m:r></span></i></m:sub></m:sSub><i |
---|
3274 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3275 | mso-fareast-font-family:"Times New Roman"'><m:r>kl</m:r></span></i></m:oMath></m:oMathPara><![endif]--><![if !msEquation]><span |
---|
3276 | style='font-size:12.0pt;font-family:"Times New Roman","serif";mso-fareast-font-family: |
---|
3277 | "Times New Roman";mso-fareast-theme-font:minor-fareast;mso-ansi-language:EN-US; |
---|
3278 | mso-fareast-language:EN-US;mso-bidi-language:AR-SA'><!--[if gte vml 1]><v:shape |
---|
3279 | id="_x0000_i1025" type="#_x0000_t75" style='width:251.25pt;height:14.25pt'> |
---|
3280 | <v:imagedata src="gsasII_files/image003.png" o:title="" chromakey="white"/> |
---|
3281 | </v:shape><![endif]--><![if !vml]><img width=335 height=19 |
---|
3282 | src="gsasII_files/image004.gif" v:shapes="_x0000_i1025"><![endif]></span><![endif]><u><span |
---|
3283 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></u></p> |
---|
3284 | |
---|
3285 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3286 | auto;text-indent:-.25in;mso-list:l0 level2 lfo14'><![if !supportLists]><span |
---|
3287 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
3288 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3289 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
3290 | "Times New Roman"'>a</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
3291 | style='mso-fareast-font-family:"Times New Roman"'>, b, c, alpha, beta, gamma</span></b><span |
---|
3292 | style='mso-fareast-font-family:"Times New Roman"'> – lattice parameters; |
---|
3293 | only those permitted by the space group are shown. The volume is computed from |
---|
3294 | the values entered.<u><o:p></o:p></u></span></p> |
---|
3295 | |
---|
3296 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
---|
3297 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
3298 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3299 | style='mso-fareast-font-family:"Times New Roman"'>If there are entries in the |
---|
3300 | Atoms page then the Elements table is shown next on the General page; you may |
---|
3301 | select the isotope (only relevant for neutron diffraction experiments). The |
---|
3302 | density is computed depending on this choice, the unit cell volume and the atom |
---|
3303 | fractions/site multiplicities in the entries on the Atoms page.<u><o:p></o:p></u></span></p> |
---|
3304 | |
---|
3305 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l0 level1 lfo14'><![if !supportLists]><span |
---|
3306 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
3307 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3308 | style='mso-fareast-font-family:"Times New Roman"'>Fourier map controls are |
---|
3309 | shown at the bottom of the General page. A completed Rietveld or Pawley |
---|
3310 | refinement is required before a Fourier map can be computed. Select the desired |
---|
3311 | type of map, the source of the reflection set and the map resolution desired.<u><o:p></o:p></u></span></p> |
---|
3312 | |
---|
3313 | <h4><a name=Data></a><u><span style='mso-fareast-font-family:"Times New Roman"'>Data |
---|
3314 | </span></u><span style='mso-fareast-font-family:"Times New Roman"'>sets<u><o:p></o:p></u></span></h4> |
---|
3315 | |
---|
3316 | <p class=MsoNormal><o:p> </o:p></p> |
---|
3317 | |
---|
3318 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?</span><i |
---|
3319 | style='mso-bidi-font-style:normal'><span style='font-family:"Cambria Math","serif"; |
---|
3320 | mso-fareast-font-family:"Times New Roman"'><br style='mso-special-character: |
---|
3321 | line-break'> |
---|
3322 | <![if !supportLineBreakNewLine]><br style='mso-special-character:line-break'> |
---|
3323 | <![endif]></span></i><span style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h5> |
---|
3324 | |
---|
3325 | <h5><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></h5> |
---|
3326 | |
---|
3327 | <h4><a name=Atoms></a><u>Atom</u> Parameter<u>s</u></h4> |
---|
3328 | |
---|
3329 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3330 | |
---|
3331 | <h4><a name=Texture></a><u>Texture</u> Parameters</h4> |
---|
3332 | |
---|
3333 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3334 | |
---|
3335 | <h4><a name="Draw_Options"></a><u>Draw Options</u></h4> |
---|
3336 | |
---|
3337 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3338 | |
---|
3339 | <h4><a name="Draw_Atoms"></a><u>Draw Atoms<o:p></o:p></u></h4> |
---|
3340 | |
---|
3341 | <p class=MsoNormal>This gives a list of the atoms and bonds that are to be |
---|
3342 | rendered as lines, van der Waals radii balls, sticks, balls & sticks, |
---|
3343 | ellipsoids & sticks or <span class=SpellE>polyhedra</span>. There are two |
---|
3344 | menus for this tab; Edit allows modification of the list of atoms to be |
---|
3345 | rendered and Compute gives some options for geometric characterization of |
---|
3346 | selected atoms.</p> |
---|
3347 | |
---|
3348 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3349 | |
---|
3350 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3351 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3352 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Atom |
---|
3353 | Selection from table: select individual atoms by a left click of the mouse when |
---|
3354 | pointed at the left most column (atom numbers) of the atom display; hold down |
---|
3355 | the Ctrl key to add to your selection; a previously selected atom will be deselected. |
---|
3356 | A selected atom will be highlighted (in grey) and the atom will be shown in |
---|
3357 | green on the plot. Selection without the Ctrl key will clear previous |
---|
3358 | selections. A double left click in the (empty) upper left box will select or |
---|
3359 | deselect all atoms.</p> |
---|
3360 | |
---|
3361 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3362 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3363 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Atom |
---|
3364 | Selection from plot: select an atom by a left click of the mouse while holding |
---|
3365 | down the Shift key and pointed at the center of the displayed atom, it will |
---|
3366 | turn green if successful and the corresponding entry in the table will be |
---|
3367 | highlighted (in grey); any previous selections will be cleared. To add to .your |
---|
3368 | selection use the right mouse button (Shift down); if a previously selection is |
---|
3369 | reselected it is removed from the selection list. <b style='mso-bidi-font-weight: |
---|
3370 | normal'>NB</b>: beware of atoms that are hiding behind the one you are trying |
---|
3371 | to select, they may be selected inadvertently. You can rotate the structure |
---|
3372 | anytime during the selection process.</p> |
---|
3373 | |
---|
3374 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3375 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
3376 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Double |
---|
3377 | left click a Name, Type and Sym Op column heading: a dialog box is shown that |
---|
3378 | allows you to select all atoms with that characteristic. For example, selecting |
---|
3379 | the Type column will show all the atom types; your choice will then cause all |
---|
3380 | those atoms to be selected.</p> |
---|
3381 | |
---|
3382 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3383 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
3384 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Double |
---|
3385 | left click a Style, Label or Color column: a dialog box is shown that allows |
---|
3386 | you to select a rendering option for all the atoms. For Color a color choice |
---|
3387 | dialog is displayed that covers the entire color spectrum. Choose a color by |
---|
3388 | any of the means available, press the “Add to Custom Colors”, |
---|
3389 | select that color in the Custom colors display and then press OK. <b |
---|
3390 | style='mso-bidi-font-weight:normal'>NB</b>: selecting Color will make all atoms |
---|
3391 | have the same color and for Style “blank” means the atoms |
---|
3392 | aren’t rendered and thus the plot will not show any atoms or bonds!</p> |
---|
3393 | |
---|
3394 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3395 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>5.<span |
---|
3396 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
3397 | ‘<b style='mso-bidi-font-weight:normal'>Edit’ - </b>The edit menu |
---|
3398 | shows operations that can be performed on your selected atoms. You must select |
---|
3399 | one or more atoms before using any of the menu items.</p> |
---|
3400 | |
---|
3401 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3402 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3403 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3404 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3405 | style='mso-bidi-font-weight:normal'>Atom style</b> – select the rendering |
---|
3406 | style for the selected atoms</p> |
---|
3407 | |
---|
3408 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3409 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3410 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3411 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3412 | style='mso-bidi-font-weight:normal'>Atom label</b> – select the item to |
---|
3413 | be shown as a label for each atom in selection. The choices are: none, type, |
---|
3414 | name or number.</p> |
---|
3415 | |
---|
3416 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3417 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3418 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
3419 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3420 | style='mso-bidi-font-weight:normal'>Atom color</b> – select the color for |
---|
3421 | the atom; a color choice dialog is displayed that covers the entire color |
---|
3422 | spectrum. Choose a color by any of the means available, press the “Add to |
---|
3423 | Custom Colors”, select that color in the Custom colors display and then |
---|
3424 | press OK.</p> |
---|
3425 | |
---|
3426 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3427 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3428 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
3429 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3430 | style='mso-bidi-font-weight:normal'>Reset atom colors</b> – return the |
---|
3431 | atom color back to their defaults for the selected atoms.</p> |
---|
3432 | |
---|
3433 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3434 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3435 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
3436 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3437 | style='mso-bidi-font-weight:normal'>View point</b> – position the plot |
---|
3438 | view point to the first atom in the selection.</p> |
---|
3439 | |
---|
3440 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3441 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3442 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
3443 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3444 | style='mso-bidi-font-weight:normal'>Add atoms</b> – using the selected |
---|
3445 | atoms, new ones are added to the bottom of the list after applying your choice |
---|
3446 | of symmetry operator and unit cell translation selected via a dialog display. |
---|
3447 | Duplicate atom positions are not retained. Any anisotropic thermal displacement |
---|
3448 | parameters (<span class=SpellE>Uij</span>) will be transformed as appropriate.</p> |
---|
3449 | |
---|
3450 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3451 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3452 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
---|
3453 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3454 | style='mso-bidi-font-weight:normal'>Transform atoms</b> – apply a |
---|
3455 | symmetry operator and unit cell translation to the set of selected atoms; they |
---|
3456 | will be changed in place. Any anisotropic thermal displacement parameters (<span |
---|
3457 | class=SpellE>Uij</span>) will be transformed as appropriate.</p> |
---|
3458 | |
---|
3459 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3460 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3461 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
---|
3462 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3463 | style='mso-bidi-font-weight:normal'>Fill CN-sphere</b> – using the atoms |
---|
3464 | currently in the draw atom table, find all atoms that belong in the |
---|
3465 | coordination sphere around the selected atoms via unit cell translations. NB: |
---|
3466 | symmetry operations are not used in this search.</p> |
---|
3467 | |
---|
3468 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3469 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3470 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
---|
3471 | style='font:7.0pt "Times New Roman"'> |
---|
3472 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Fill unit |
---|
3473 | cell</b> - using the atoms currently selected from the draw atom table, find |
---|
3474 | all atoms that fall inside or on the edge/surface/corners of the unit cell. |
---|
3475 | This operation is frequently performed before Fill CN-sphere.</p> |
---|
3476 | |
---|
3477 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3478 | auto;text-indent:-.25in;mso-list:l14 level1 lfo16'><![if !supportLists]><span |
---|
3479 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
---|
3480 | style='font:7.0pt "Times New Roman"'> |
---|
3481 | </span></span></span><![endif]><b style='mso-bidi-font-weight:normal'>Delete |
---|
3482 | atoms</b> – clear the entire draw atom table; it is then refilled from |
---|
3483 | the Atoms table. You should do this operation after any changes in the Atoms |
---|
3484 | table, e.g. by a structure refinement.</p> |
---|
3485 | |
---|
3486 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l10 level1 lfo15'><![if !supportLists]><span |
---|
3487 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>6.<span |
---|
3488 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
3489 | ‘<b style='mso-bidi-font-weight:normal'>Compute’</b> - The compute |
---|
3490 | menu gives a choice of geometric calculations to be performed with the selected |
---|
3491 | atoms. You must select the appropriate number of atoms for these to work and |
---|
3492 | the computation is done for the atoms in selection order.</p> |
---|
3493 | |
---|
3494 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3495 | auto;text-indent:-.25in;mso-list:l13 level1 lfo17'><![if !supportLists]><span |
---|
3496 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3497 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3498 | style='mso-bidi-font-weight:normal'>Dist. Ang.</b> <b style='mso-bidi-font-weight: |
---|
3499 | normal'>Tors. </b>– <span class=GramE>when</span> 2-4 atoms are selected, |
---|
3500 | a distance, angle or torsion angle will be found for them. The angles are |
---|
3501 | computed for the atoms in their selection order. The torsion angle is a right |
---|
3502 | hand angle about the A2-A3 vector for the sequence of atoms A1-A2-A3-A4. An |
---|
3503 | estimated standard deviation is given for the calculated value if a current |
---|
3504 | variance-covariance matrix is available. The result is shown on the console |
---|
3505 | window; it may be cut & pasted to another application (e.g. Microsoft |
---|
3506 | Word).</p> |
---|
3507 | |
---|
3508 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
3509 | text-indent:-.25in;mso-list:l13 level1 lfo17'><![if !supportLists]><span |
---|
3510 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3511 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3512 | style='mso-bidi-font-weight:normal'>Best plane</b> – when 4 or more atoms |
---|
3513 | are selected, a best plane is determined for them. The result is shown on the |
---|
3514 | console window; it may be cut & pasted to another application (e.g. Microsoft |
---|
3515 | Word). Shown are the atom coordinates transformed to Cartesian best plane |
---|
3516 | coordinates where the largest range is over the X-axis and the smallest is over |
---|
3517 | the Z-axis with the origin at the <span class=SpellE>unweighted</span> center |
---|
3518 | of the selection. Root mean square displacements along each axis for the best |
---|
3519 | plane are also listed. The Z-axis RMS value indicates the flatness of the |
---|
3520 | proposed plane. <b style='mso-bidi-font-weight:normal'>NB</b>: if you select |
---|
3521 | (e.g. all) atoms then Best plane will give Cartesian coordinates for these |
---|
3522 | atoms with respect to a coordinate system where the X-axis is along the longest |
---|
3523 | axis of the atom grouping and the Z-axis is along the shortest distance. The |
---|
3524 | origin is at the <span class=SpellE>unweighted</span> center of the selected |
---|
3525 | atoms.</p> |
---|
3526 | |
---|
3527 | <h4><a name=Pawley><u>Pawley </u></a><u>reflections<o:p></o:p></u></h4> |
---|
3528 | |
---|
3529 | <p class=MsoNormal>This gives the list of reflections used in a Pawley refinement |
---|
3530 | and can only be seen if the phase type is ‘Pawley’ (see<span |
---|
3531 | style='color:#00B0F0'> </span><a href="#General">General</a>)<span |
---|
3532 | style='color:#00B0F0'>.</span></p> |
---|
3533 | |
---|
3534 | <h5>What can I do here?</h5> |
---|
3535 | |
---|
3536 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
---|
3537 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3538 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
3539 | <b style='mso-bidi-font-weight:normal'>‘Operations’</b> –</p> |
---|
3540 | |
---|
3541 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3542 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
---|
3543 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3544 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3545 | style='mso-bidi-font-weight:normal'>Pawley create</b> – this creates a |
---|
3546 | new set of Pawley reflections, over writing any preexisting Pawley set. They |
---|
3547 | are generated with d-<span class=SpellE>spacings</span> larger than the limit |
---|
3548 | set as ‘Pawley <span class=SpellE>dmin</span>’ in the General tab |
---|
3549 | for this phase. By default the refine flags are not set and the <span |
---|
3550 | class=SpellE><span class=GramE>Fsq</span></span><span class=GramE>(</span><span |
---|
3551 | class=SpellE>hkl</span>) = 100.0.</p> |
---|
3552 | |
---|
3553 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3554 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
---|
3555 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3556 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3557 | style='mso-bidi-font-weight:normal'>Pawley estimate</b> – this attempts |
---|
3558 | an estimate of <span class=SpellE><span class=GramE>Fsq</span></span><span |
---|
3559 | class=GramE>(</span><span class=SpellE>hkl</span>) from the peak heights of the |
---|
3560 | reflection as seen in the 1<sup>st</sup> powder pattern of those selected in |
---|
3561 | the <a href="#Data">Data</a> tab.</p> |
---|
3562 | |
---|
3563 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3564 | auto;text-indent:-.25in;mso-list:l12 level2 lfo19'><![if !supportLists]><span |
---|
3565 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
3566 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3567 | style='mso-bidi-font-weight:normal'>Pawley delete </b>– this clears the |
---|
3568 | set of Pawley reflections.</p> |
---|
3569 | |
---|
3570 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
---|
3571 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3572 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>You |
---|
3573 | can change the refine flags either by clicking on the box or by selecting one |
---|
3574 | and then selecting the column (a single click on the column heading). Then type |
---|
3575 | ‘y’ to set the refine flags or ‘n’ to clear the flags. |
---|
3576 | You should deselect those reflections that fall below the lower limit or above |
---|
3577 | the upper limit of the powder pattern otherwise you may have a singular matrix |
---|
3578 | error in your Pawley refinement.</p> |
---|
3579 | |
---|
3580 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l5 level1 lfo18'><![if !supportLists]><span |
---|
3581 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
3582 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>You |
---|
3583 | can change the individual <span class=SpellE><span class=GramE>Fsq</span></span><span |
---|
3584 | class=GramE>(</span><span class=SpellE>hkl</span>) values by selecting it, |
---|
3585 | typing in the new value and then pressing enter or selecting somewhere else in |
---|
3586 | the table.</p> |
---|
3587 | |
---|
3588 | <p class=MsoListParagraphCxSpLast><o:p> </o:p></p> |
---|
3589 | |
---|
3590 | <h4><a name="Map_peaks">Map peaks</a></h4> |
---|
3591 | |
---|
3592 | <span style='mso-bookmark:Map_peaks'></span> |
---|
3593 | |
---|
3594 | <p class=MsoNormal>This gives the list (magnitude, x y & z) of all peaks |
---|
3595 | found within the unit cell from the last Fourier map search sorted in order of |
---|
3596 | decreasing peak magnitude. The crystal structure plot shows each peak position |
---|
3597 | as a white 3-D cross.</p> |
---|
3598 | |
---|
3599 | <h5>What can I do here?<o:p></o:p></h5> |
---|
3600 | |
---|
3601 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l22 level1 lfo24'><![if !supportLists]><span |
---|
3602 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3603 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Select |
---|
3604 | a peak with a left click on the left hand row number, hold Ctrl key down to add |
---|
3605 | more peaks to your selection. Each peak selected will show as a green 3-D cross |
---|
3606 | on the crystal structure plot.<o:p></o:p></p> |
---|
3607 | |
---|
3608 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l22 level1 lfo24'><![if !supportLists]><span |
---|
3609 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3610 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Menu |
---|
3611 | <b style='mso-bidi-font-weight:normal'>‘Map peaks’ </b><span |
---|
3612 | style='mso-spacerun:yes'> </span>–</p> |
---|
3613 | |
---|
3614 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3615 | auto;text-indent:-.25in;mso-list:l22 level2 lfo24;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3616 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3617 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3618 | style='mso-bidi-font-weight:normal'>Move peaks</b> – this copies selected |
---|
3619 | peaks to the <a href="gsasII.html">Atoms</a> list and the <a href="gsasII.html">Draw |
---|
3620 | Atoms</a> list. They will be appended to the end of each list each with the |
---|
3621 | name ‘UNK’ and the atom type as ‘H’. They will also be |
---|
3622 | drawn as small white spheres at their respective positions in the structure |
---|
3623 | drawing. You should next go to the <a href="gsasII.html">Atoms</a> page and |
---|
3624 | change the atom type to whatever element you desire; it will be renamed |
---|
3625 | automatically.</p> |
---|
3626 | |
---|
3627 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
3628 | text-indent:-.25in;mso-list:l22 level2 lfo24;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3629 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3630 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3631 | style='mso-bidi-font-weight:normal'>Clear peaks </b>– this deletes all the |
---|
3632 | peaks in the map peak list; they are also removed from the crystal structure |
---|
3633 | drawing plot.</p> |
---|
3634 | |
---|
3635 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
3636 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
3637 | |
---|
3638 | <hr size=2 width="100%" align=center> |
---|
3639 | |
---|
3640 | </span></div> |
---|
3641 | |
---|
3642 | <div class=MsoNormal align=center style='text-align:center'><span |
---|
3643 | style='mso-fareast-font-family:"Times New Roman"'> |
---|
3644 | |
---|
3645 | <hr size=2 width="100%" align=center> |
---|
3646 | |
---|
3647 | </span></div> |
---|
3648 | |
---|
3649 | <h2><a name=Plots><span style='mso-fareast-font-family:"Times New Roman"'>3. |
---|
3650 | GSAS-II Plots Window</span></a><span style='mso-bookmark:Plots'></span><span |
---|
3651 | style='mso-fareast-font-family:"Times New Roman";font-weight:normal'> </span><span |
---|
3652 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h2> |
---|
3653 | |
---|
3654 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3655 | window presents all the graphical material as a multipage tabbed set of plots |
---|
3656 | utilizing the <span class=SpellE>matplotlib</span> python package. Each page |
---|
3657 | has a tool bar (at bottom in Windows) with the controls<o:p></o:p></span></p> |
---|
3658 | |
---|
3659 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"; |
---|
3660 | mso-no-proof:yes'><img border=0 width=225 height=31 id="_x0000_i1032" |
---|
3661 | src=graphbar.jpg alt="Description: D:\pyGSAS\help\graphbar.jpg"></span><span |
---|
3662 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></p> |
---|
3663 | |
---|
3664 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>These |
---|
3665 | are Home, Back, Forward, Pan, Zoom, Save and Help, respectively. <o:p></o:p></span></p> |
---|
3666 | |
---|
3667 | <ul type=disc> |
---|
3668 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3669 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3670 | "Times New Roman"'>Home: returns the plot to the initial scaling <o:p></o:p></span></li> |
---|
3671 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3672 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3673 | "Times New Roman"'>Back: returns the plot to the previous scaling <o:p></o:p></span></li> |
---|
3674 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3675 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3676 | "Times New Roman"'>Forward: reverses the action in the previous press(es) |
---|
3677 | of the Back button <o:p></o:p></span></li> |
---|
3678 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3679 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3680 | "Times New Roman"'>Pan: allows you to control panning across the plot |
---|
3681 | (press left mouse button) and zooming (press right mouse button), <o:p></o:p></span></li> |
---|
3682 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3683 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3684 | "Times New Roman"'>Zoom: allows you to select a portion of the plot (press |
---|
3685 | right mouse button & drag for zoom box) for the next plot. <o:p></o:p></span></li> |
---|
3686 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3687 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3688 | "Times New Roman"'>Save: allows you to save the currently displayed plot |
---|
3689 | in one of several graphical formats suitable for printing or insertion in |
---|
3690 | a document.<o:p></o:p></span></li> |
---|
3691 | <li class=MsoNormal style='mso-margin-top-alt:auto;mso-margin-bottom-alt:auto; |
---|
3692 | mso-list:l1 level1 lfo20;tab-stops:list .5in'><span style='mso-fareast-font-family: |
---|
3693 | "Times New Roman"'>Help: accesses GSASII help on the specific plot type. <o:p></o:p></span></li> |
---|
3694 | </ul> |
---|
3695 | |
---|
3696 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
3697 | |
---|
3698 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>Below |
---|
3699 | the toolbar may be a status bar that on the left may show either an instruction |
---|
3700 | for a keyed input or a pull down selection of keyed input; on the right may be |
---|
3701 | displayed position dependent information that is updated as the mouse is moved |
---|
3702 | over the plot region.<o:p></o:p></span></p> |
---|
3703 | |
---|
3704 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
3705 | |
---|
3706 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
---|
3707 | specific types of plots that are pages in the GSASII Plots windows are next.<o:p></o:p></span></p> |
---|
3708 | |
---|
3709 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Powder Patterns<o:p></o:p></span></h4> |
---|
3710 | |
---|
3711 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
---|
3712 | powder patterns that are part of your project are shown on this page. They can be |
---|
3713 | displayed as a stack of powder patterns, just a single pattern or as a contour |
---|
3714 | image of the peak intensities. What can be done here will depend on which is |
---|
3715 | displayed and on which item in the GSAS-II data tree you have selected.<o:p></o:p></span></p> |
---|
3716 | |
---|
3717 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3718 | |
---|
3719 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l4 level1 lfo21'><![if !supportLists]><span |
---|
3720 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3721 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3722 | style='mso-fareast-font-family:"Times New Roman"'>Move the mouse cursor across |
---|
3723 | the plot, the plot status line will show the cursor position in 2</span><span |
---|
3724 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>Q</span><span |
---|
3725 | style='mso-fareast-font-family:"Times New Roman"'>, d-spacing and the |
---|
3726 | intensity. For a q-plot, q is shown instead of 2</span><span style='font-family: |
---|
3727 | Symbol;mso-fareast-font-family:"Times New Roman"'>Q</span><span |
---|
3728 | style='mso-fareast-font-family:"Times New Roman"'>.<o:p></o:p></span></p> |
---|
3729 | |
---|
3730 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo21'><![if !supportLists]><span |
---|
3731 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3732 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>On |
---|
3733 | the plot status line<b style='mso-bidi-font-weight:normal'> ‘key |
---|
3734 | press’ </b>– you can either press the key on the key board or |
---|
3735 | select from the pull down menu. For line plots:</p> |
---|
3736 | |
---|
3737 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3738 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3739 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3740 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3741 | class=GramE><b style='mso-bidi-font-weight:normal'>l</b></span><b |
---|
3742 | style='mso-bidi-font-weight:normal'>: offset left</b> – for a waterfall |
---|
3743 | plot of multiple powder profiles, increase the offset to the left. Does not |
---|
3744 | apply if only one pattern.</p> |
---|
3745 | |
---|
3746 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3747 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3748 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3749 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3750 | class=GramE><b style='mso-bidi-font-weight:normal'>r</b></span><b |
---|
3751 | style='mso-bidi-font-weight:normal'>: offset right</b> - for a waterfall plot |
---|
3752 | of multiple powder profiles, increase the offset to the left. Does not apply if |
---|
3753 | only one pattern.</p> |
---|
3754 | |
---|
3755 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3756 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3757 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
3758 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3759 | class=GramE><b style='mso-bidi-font-weight:normal'>d</b></span><b |
---|
3760 | style='mso-bidi-font-weight:normal'>: offset down</b> - for a waterfall plot of |
---|
3761 | multiple powder profiles, increase the offset down. Does not apply if only one |
---|
3762 | pattern.</p> |
---|
3763 | |
---|
3764 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3765 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3766 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
3767 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3768 | class=GramE><b style='mso-bidi-font-weight:normal'>u</b></span><b |
---|
3769 | style='mso-bidi-font-weight:normal'>: offset up</b> - for a waterfall plot of |
---|
3770 | multiple powder profiles, increase the offset up. Does not apply if only one |
---|
3771 | pattern.</p> |
---|
3772 | |
---|
3773 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3774 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3775 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
3776 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3777 | class=GramE><b style='mso-bidi-font-weight:normal'>o</b></span><b |
---|
3778 | style='mso-bidi-font-weight:normal'>: reset offset</b> - for a waterfall plot |
---|
3779 | of multiple powder profiles, reset to no offset. Does not apply if only one |
---|
3780 | pattern.</p> |
---|
3781 | |
---|
3782 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3783 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3784 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>f.<span |
---|
3785 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3786 | class=GramE><b style='mso-bidi-font-weight:normal'>n</b></span><b |
---|
3787 | style='mso-bidi-font-weight:normal'>: log(I) on/off</b> – changes the |
---|
3788 | y-axis to be the log10 of the intensity; difference curve is not shown for |
---|
3789 | log(I) on.</p> |
---|
3790 | |
---|
3791 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3792 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3793 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>g.<span |
---|
3794 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3795 | class=GramE><b style='mso-bidi-font-weight:normal'>c</b></span><b |
---|
3796 | style='mso-bidi-font-weight:normal'>: contour on/off</b> – if multiple |
---|
3797 | powder profiles, then a contour plot is shown of the observed intensities. All |
---|
3798 | data sets must be the same length as the first one to be included in the |
---|
3799 | contour plot.</p> |
---|
3800 | |
---|
3801 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3802 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3803 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>h.<span |
---|
3804 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3805 | style='mso-bidi-font-weight:normal'>q: toggle q plot</b> – changes the |
---|
3806 | x-axis from 2<span style='font-family:Symbol'>Q</span> to q=2<span |
---|
3807 | style='font-family:Symbol'>p</span>/d. This will put multiple powder patterns |
---|
3808 | taken at different energies on the same x-axis scale.</p> |
---|
3809 | |
---|
3810 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3811 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3812 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>i.<span |
---|
3813 | style='font:7.0pt "Times New Roman"'> |
---|
3814 | </span></span></span><![endif]><span class=GramE><b style='mso-bidi-font-weight: |
---|
3815 | normal'>s</b></span><b style='mso-bidi-font-weight:normal'>: toggle single plot</b> |
---|
3816 | – for multiple powder profiles, this will show only the one selected from |
---|
3817 | the data tree. The offset options are not active.</p> |
---|
3818 | |
---|
3819 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3820 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3821 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>j.<span |
---|
3822 | style='font:7.0pt "Times New Roman"'> |
---|
3823 | </span></span></span><![endif]><span class=GramE><b style='mso-bidi-font-weight: |
---|
3824 | normal'>w</b></span><b style='mso-bidi-font-weight:normal'>: toggle divide by |
---|
3825 | sig</b> – for the pattern selected from the data tree, this will divide |
---|
3826 | the observed, calculated and difference curves by the <span class=SpellE>esd</span> |
---|
3827 | for the data points. Other data sets are not shown.</p> |
---|
3828 | |
---|
3829 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3830 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3831 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>k.<span |
---|
3832 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3833 | style='mso-bidi-font-weight:normal'>+: no selection</b> - for multiple powder |
---|
3834 | profiles, only the observed curve is shown.</p> |
---|
3835 | |
---|
3836 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo21'><![if !supportLists]><span |
---|
3837 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
3838 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3839 | style='mso-fareast-font-family:"Times New Roman"'>For contour plots the status |
---|
3840 | line ‘key press’ options are different:<o:p></o:p></span></p> |
---|
3841 | |
---|
3842 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3843 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3844 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3845 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3846 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
3847 | "Times New Roman"'>d</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
3848 | style='mso-fareast-font-family:"Times New Roman"'>: lower contour max</span></b><span |
---|
3849 | style='mso-fareast-font-family:"Times New Roman"'> – this lowers the |
---|
3850 | level chosen for the highest contour color.<o:p></o:p></span></p> |
---|
3851 | |
---|
3852 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3853 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3854 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3855 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3856 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>u: |
---|
3857 | raise contour max</span></b><span style='mso-fareast-font-family:"Times New Roman"'> |
---|
3858 | – this raises the level chosen for the highest contour color<o:p></o:p></span></p> |
---|
3859 | |
---|
3860 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3861 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3862 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>c.<span |
---|
3863 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3864 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
3865 | "Times New Roman"'>i</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
3866 | style='mso-fareast-font-family:"Times New Roman"'>: interpolation method</span></b><span |
---|
3867 | style='mso-fareast-font-family:"Times New Roman"'> – this changes the |
---|
3868 | method used to represent the contours. If selected a dialog box appears with |
---|
3869 | all the possible choices. Default is ‘nearest’; the other useful |
---|
3870 | choice is ‘bilinear’, this will smooth out the contours. <o:p></o:p></span></p> |
---|
3871 | |
---|
3872 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3873 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3874 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>d.<span |
---|
3875 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3876 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
3877 | "Times New Roman"'>s</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
3878 | style='mso-fareast-font-family:"Times New Roman"'>: color scheme</span></b><span |
---|
3879 | style='mso-fareast-font-family:"Times New Roman"'> – this changes the |
---|
3880 | color scheme for the contouring. Default is <span class=GramE>‘Paired’,</span> |
---|
3881 | black/ white options are ‘Greys’ and ‘binary’ (for |
---|
3882 | black on white) or ‘gray’ (for white on black). Others can be very |
---|
3883 | colorful (but not useful)!<o:p></o:p></span></p> |
---|
3884 | |
---|
3885 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3886 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3887 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>e.<span |
---|
3888 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3889 | class=GramE><b style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family: |
---|
3890 | "Times New Roman"'>c</span></b></span><b style='mso-bidi-font-weight:normal'><span |
---|
3891 | style='mso-fareast-font-family:"Times New Roman"'>: contour off/on</span></b><span |
---|
3892 | style='mso-fareast-font-family:"Times New Roman"'> – this turns off |
---|
3893 | contouring and returns to a waterfall plot with any offsets applied.<o:p></o:p></span></p> |
---|
3894 | |
---|
3895 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l4 level1 lfo21'><![if !supportLists]><span |
---|
3896 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>4.<span |
---|
3897 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3898 | style='mso-fareast-font-family:"Times New Roman"'>Depending on the item chosen |
---|
3899 | for the selected powder pattern in the data tree, the mouse buttons have |
---|
3900 | different actions:<o:p></o:p></span></p> |
---|
3901 | |
---|
3902 | <p class=MsoListParagraphCxSpMiddle style='margin-left:1.0in;mso-add-space: |
---|
3903 | auto;text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3904 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>a.<span |
---|
3905 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><b |
---|
3906 | style='mso-bidi-font-weight:normal'><span style='mso-fareast-font-family:"Times New Roman"'>Limits</span></b><span |
---|
3907 | style='mso-fareast-font-family:"Times New Roman"'> - Modify the values of |
---|
3908 | ‘changed’; this can be done on the plot by dragging the limit bars |
---|
3909 | (left – vertical green dashed line, right – vertical red dashed |
---|
3910 | line) into position. A left or right mouse click on a data point on the plot |
---|
3911 | will set the associated limit. In either case the appropriate value on the |
---|
3912 | ‘changed’ row will be updated immediately.<o:p></o:p></span></p> |
---|
3913 | |
---|
3914 | <p class=MsoListParagraphCxSpLast style='margin-left:1.0in;mso-add-space:auto; |
---|
3915 | text-indent:-.25in;mso-list:l4 level2 lfo21;tab-stops:list 1.0in'><![if !supportLists]><span |
---|
3916 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>b.<span |
---|
3917 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3918 | style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
3919 | |
---|
3920 | <p class=MsoNormal style='margin-left:.5in'><span style='mso-fareast-font-family: |
---|
3921 | "Times New Roman"'><o:p> </o:p></span></p> |
---|
3922 | |
---|
3923 | <h4><a name=Covariance><span style='mso-fareast-font-family:"Times New Roman"'>Covariance</span></a><span |
---|
3924 | style='mso-fareast-font-family:"Times New Roman"'><o:p></o:p></span></h4> |
---|
3925 | |
---|
3926 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>The |
---|
3927 | variance-covariance matrix as a color coded array is shown on this page. The |
---|
3928 | color bar to the right shows the range of <span class=SpellE>covariances</span> |
---|
3929 | (-1 to 1) and corresponding colors. The parameter names are to the right and |
---|
3930 | the parameter numbers are below the plot.<o:p></o:p></span></p> |
---|
3931 | |
---|
3932 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3933 | |
---|
3934 | <p class=MsoListParagraphCxSpFirst style='text-indent:-.25in;mso-list:l7 level1 lfo22'><![if !supportLists]><span |
---|
3935 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>1.<span |
---|
3936 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Move |
---|
3937 | the mouse cursor across the plot. If on a diagonal cell, the parameter name, |
---|
3938 | value and <span class=SpellE>esd</span> is shown both as a tool tip and in the |
---|
3939 | right hand portion of the status bar. If the cursor is off the diagonal, the |
---|
3940 | two parameter names and their covariance are shown in the tool tip and the |
---|
3941 | status bar.</p> |
---|
3942 | |
---|
3943 | <p class=MsoListParagraphCxSpMiddle style='text-indent:-.25in;mso-list:l7 level1 lfo22'><![if !supportLists]><span |
---|
3944 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>2.<span |
---|
3945 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]>Use |
---|
3946 | the Zoom and Pan buttons to focus on some section of the variance-covariance |
---|
3947 | matrix. </p> |
---|
3948 | |
---|
3949 | <p class=MsoListParagraphCxSpLast style='text-indent:-.25in;mso-list:l7 level1 lfo22'><![if !supportLists]><span |
---|
3950 | style='mso-fareast-font-family:"Times New Roman"'><span style='mso-list:Ignore'>3.<span |
---|
3951 | style='font:7.0pt "Times New Roman"'> </span></span></span><![endif]><span |
---|
3952 | class=GramE>Type ‘s’</span> – A color scheme selection dialog |
---|
3953 | is shown. Select a color scheme and press <span class=GramE>OK,</span> the new |
---|
3954 | color scheme will be plotted. The default is ‘<span class=SpellE>RdYlGn</span>’.</p> |
---|
3955 | |
---|
3956 | <h4><a name="Structure_Factors"><span style='mso-fareast-font-family:"Times New Roman"'>Structure |
---|
3957 | Factors </span></a></h4> |
---|
3958 | |
---|
3959 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3960 | plot shows... <o:p></o:p></span></p> |
---|
3961 | |
---|
3962 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3963 | |
---|
3964 | <h4><a name="Powder_Lines"><span style='mso-fareast-font-family:"Times New Roman"'>Powder |
---|
3965 | Lines </span></a></h4> |
---|
3966 | |
---|
3967 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3968 | plot shows the line positions for the peak list<o:p></o:p></span></p> |
---|
3969 | |
---|
3970 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'><o:p> </o:p></span></p> |
---|
3971 | |
---|
3972 | <h4><a name="Powder_Patterns"></a><span style='mso-fareast-font-family:"Times New Roman"'>Powder |
---|
3973 | Patterns<o:p></o:p></span></h4> |
---|
3974 | |
---|
3975 | <p class=MsoNormal>This plot shows….</p> |
---|
3976 | |
---|
3977 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
3978 | |
---|
3979 | <h4><a name="Peak_Widths"><span style='mso-fareast-font-family:"Times New Roman"'>Peak |
---|
3980 | Widths </span></a></h4> |
---|
3981 | |
---|
3982 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
3983 | plot shows the contributions to the powder pattern peak widths as </span><span |
---|
3984 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>D</span><span |
---|
3985 | style='mso-fareast-font-family:"Times New Roman"'>d/d (= </span><span |
---|
3986 | style='font-family:Symbol;mso-fareast-font-family:"Times New Roman"'>D</span><span |
---|
3987 | style='mso-fareast-font-family:"Times New Roman"'>q/q) <span class=SpellE>vs</span> |
---|
3988 | <span class=GramE>q(</span>=2</span><span style='font-family:Symbol;mso-fareast-font-family: |
---|
3989 | "Times New Roman"'>p</span><span style='mso-fareast-font-family:"Times New Roman"'>/d) |
---|
3990 | from the Gaussian and <span class=SpellE>Lorentzian</span> parts of the profile |
---|
3991 | function. The computed curves are based on the values of U, V, W, X and Y shown |
---|
3992 | in the Instrument Parameters window in parentheses. These are the values for |
---|
3993 | the instrument contribution that were set when the powder pattern was first |
---|
3994 | read in to GSAS-II. If individual peak fitting has been performed, the values |
---|
3995 | of ‘sig’ & ‘gam’ for the peaks are plotted as |
---|
3996 | ‘+’; these are computed from the fitted values of U, V, W, X and Y |
---|
3997 | as well as any sig or gam individually refined.<o:p></o:p></span></p> |
---|
3998 | |
---|
3999 | <h4><span style='mso-fareast-font-family:"Times New Roman"'>Texture </span></h4> |
---|
4000 | |
---|
4001 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
4002 | plot shows... <o:p></o:p></span></p> |
---|
4003 | |
---|
4004 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
4005 | |
---|
4006 | <h4><a name="Sequential_refinement"></a><span style='mso-fareast-font-family: |
---|
4007 | "Times New Roman"'>Sequential refinement </span></h4> |
---|
4008 | |
---|
4009 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
4010 | plot shows the variation of the selected parameters with respect to the data |
---|
4011 | sequence number.<o:p></o:p></span></p> |
---|
4012 | |
---|
4013 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
4014 | |
---|
4015 | <h4><a name="2D_Powder_Image"><span style='mso-fareast-font-family:"Times New Roman"'>2D |
---|
4016 | Powder Image </span></a></h4> |
---|
4017 | |
---|
4018 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
4019 | plot shows... <o:p></o:p></span></p> |
---|
4020 | |
---|
4021 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
4022 | |
---|
4023 | <h4><a name="2D_Integration"><span style='mso-fareast-font-family:"Times New Roman"'>2D |
---|
4024 | Integration </span></a></h4> |
---|
4025 | |
---|
4026 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
4027 | plot shows... <o:p></o:p></span></p> |
---|
4028 | |
---|
4029 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
4030 | |
---|
4031 | <h4><a name="2D_Transformed_Powder_Image"><span style='mso-fareast-font-family: |
---|
4032 | "Times New Roman"'>2D Transformed Powder Image </span></a></h4> |
---|
4033 | |
---|
4034 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
---|
4035 | plot shows... <o:p></o:p></span></p> |
---|
4036 | |
---|
4037 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
---|
4038 | |
---|
4039 | <h4><a name=Mustrain><span style='mso-fareast-font-family:"Times New Roman"'>Mustrain |
---|
4040 | </span></a></h4> |
---|
4041 | |
---|
4042 | <p class=MsoNormal><span style='mso-fareast-font-family:"Times New Roman"'>This |
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4043 | plot shows... <o:p></o:p></span></p> |
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4044 | |
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4045 | <h5><span style='mso-fareast-font-family:"Times New Roman"'>What can I do here?<o:p></o:p></span></h5> |
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4046 | |
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4047 | <h4><a name=Size><span style='mso-fareast-font-family:"Times New Roman"'>Size </span></a></ |
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