Changeset 3055 for Tutorials/2DTexture
- Timestamp:
- Sep 8, 2017 1:47:41 PM (6 years ago)
- Location:
- Tutorials/2DTexture
- Files:
-
- 115 added
- 51 deleted
- 53 edited
Legend:
- Unmodified
- Added
- Removed
-
Tutorials/2DTexture/Texture analysis of 2D data in GSAS-II.htm
r2385 r3055 24 24 <o:DocumentProperties> 25 25 <o:Author>Von Dreele</o:Author> 26 <o:LastAuthor> Von Dreele</o:LastAuthor>27 <o:Revision>1 0</o:Revision>28 <o:TotalTime>2 143</o:TotalTime>26 <o:LastAuthor>vondreele</o:LastAuthor> 27 <o:Revision>12</o:Revision> 28 <o:TotalTime>2274</o:TotalTime> 29 29 <o:Created>2015-05-14T17:06:00Z</o:Created> 30 <o:LastSaved>201 6-07-28T18:35:00Z</o:LastSaved>31 <o:Pages> 54</o:Pages>32 <o:Words>43 39</o:Words>33 <o:Characters>24 736</o:Characters>30 <o:LastSaved>2017-09-08T18:45:00Z</o:LastSaved> 31 <o:Pages>47</o:Pages> 32 <o:Words>4356</o:Words> 33 <o:Characters>24830</o:Characters> 34 34 <o:Company>Argonne National Laboratory</o:Company> 35 35 <o:Lines>206</o:Lines> 36 36 <o:Paragraphs>58</o:Paragraphs> 37 <o:CharactersWithSpaces>29 017</o:CharactersWithSpaces>37 <o:CharactersWithSpaces>29128</o:CharactersWithSpaces> 38 38 <o:Version>16.00</o:Version> 39 39 </o:DocumentProperties> … … 49 49 <w:WordDocument> 50 50 <w:View>Print</w:View> 51 <w:Zoom>124</w:Zoom> 51 52 <w:SpellingState>Clean</w:SpellingState> 52 53 <w:GrammarState>Clean</w:GrammarState> … … 678 679 mso-generic-font-family:swiss; 679 680 mso-font-pitch:variable; 680 mso-font-signature:-5368 70145 1073786111 1 0 4150;}681 mso-font-signature:-536859905 -1073732485 9 0 511 0;} 681 682 @font-face 682 683 {font-family:Tahoma; … … 1413 1414 mso-ascii-theme-font:minor-latin; 1414 1415 mso-hansi-font-family:Calibri; 1415 mso-hansi-theme-font:minor-latin;} 1416 mso-hansi-theme-font:minor-latin; 1417 mso-bidi-font-family:"Times New Roman"; 1418 mso-bidi-theme-font:minor-bidi;} 1416 1419 </style> 1417 1420 <![endif]--><!--[if gte mso 9]><xml> … … 1523 1526 o:title="" chromakey="white"/> 1524 1527 </v:shape><![endif]--><![if !vml]><img width=357 height=56 1525 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 02.png"1528 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image051.png" 1526 1529 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 1527 1530 … … 1547 1550 o:title="" chromakey="white"/> 1548 1551 </v:shape><![endif]--><![if !vml]><img width=43 height=35 1549 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 04.png"1552 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image052.png" 1550 1553 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 1551 1554 style='mso-spacerun:yes'> </span>and <!--[if gte msEquation 12]><m:oMath><m:sSubSup><m:sSubSupPr><span … … 1565 1568 o:title="" chromakey="white"/> 1566 1569 </v:shape><![endif]--><![if !vml]><img width=40 height=35 1567 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 06.png"1570 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image053.png" 1568 1571 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, take on values according 1569 1572 to the crystal and sample symmetries, respectively, and thus the two inner … … 1590 1593 o:title="" chromakey="white"/> 1591 1594 </v:shape><![endif]--><![if !vml]><img width=39 height=35 1592 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 08.png"1595 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image054.png" 1593 1596 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 1594 1597 style='mso-spacerun:yes'> </span>terms are nonzero so the rest are excluded … … 1608 1611 o:title="" chromakey="white"/> 1609 1612 </v:shape><![endif]--><![if !vml]><img width=28 height=35 1610 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 10.png"1613 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image055.png" 1611 1614 v:shapes="_x0000_i1025"><![endif]></span><![endif]>coefficients is sufficient 1612 1615 to describe the effect on the diffraction patterns due to texture. The crystal … … 1627 1630 o:title="" chromakey="white"/> 1628 1631 </v:shape><![endif]--><![if !vml]><img width=43 height=35 1629 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 12.png"1632 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image056.png" 1630 1633 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, is defined for each 1631 1634 reflection, h, <i>via</i> polar and azimuthal coordinates (<span … … 1653 1656 o:title="" chromakey="white"/> 1654 1657 </v:shape><![endif]--><![if !vml]><img width=40 height=35 1655 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 06.png"1658 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image053.png" 1656 1659 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, is defined according to 1657 1660 polar and azimuthal coordinates (<span style='font-family:Symbol'>y</span>, <span … … 1724 1727 "Times New Roman";mso-fareast-theme-font:minor-fareast;mso-ansi-language:EN-US; 1725 1728 mso-fareast-language:EN-US;mso-bidi-language:AR-SA'><!--[if gte vml 1]><v:shape 1726 id="_x0000_i1025" type="#_x0000_t75" style='width:32 0.95pt;height:54pt'>1729 id="_x0000_i1025" type="#_x0000_t75" style='width:321pt;height:54pt'> 1727 1730 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image013.png" 1728 1731 o:title="" chromakey="white"/> 1729 1732 </v:shape><![endif]--><![if !vml]><img width=428 height=72 1730 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 14.png"1733 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image057.png" 1731 1734 v:shapes="_x0000_i1025"><![endif]></span><![endif]><br style='mso-special-character: 1732 1735 line-break'> … … 1810 1813 o:title="" chromakey="white"/> 1811 1814 </v:shape><![endif]--><![if !vml]><img width=45 height=67 1812 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 16.png"1815 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image058.png" 1813 1816 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 1814 1817 style='mso-spacerun:yes'> </span>and<span style='mso-spacerun:yes'> </span><i>tan</i>(<span … … 1847 1850 o:title="" chromakey="white"/> 1848 1851 </v:shape><![endif]--><![if !vml]><img width=107 height=67 1849 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 18.png"1852 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image059.png" 1850 1853 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 1851 1854 … … 1867 1870 o:title="" chromakey="white"/> 1868 1871 </v:shape><![endif]--><![if !vml]><img width=62 height=35 1869 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 20.png"1872 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image060.png" 1870 1873 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 1871 1874 style='mso-spacerun:yes'> </span>and <!--[if gte msEquation 12]><m:oMath><m:sSubSup><m:sSubSupPr><span … … 1885 1888 o:title="" chromakey="white"/> 1886 1889 </v:shape><![endif]--><![if !vml]><img width=57 height=35 1887 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 22.png"1890 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image061.png" 1888 1891 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, are developed from</p> 1889 1892 … … 1940 1943 o:title="" chromakey="white"/> 1941 1944 </v:shape><![endif]--><![if !vml]><img width=220 height=56 1942 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 24.png"1945 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image062.png" 1943 1946 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 1944 1947 … … 1964 1967 o:title="" chromakey="white"/> 1965 1968 </v:shape><![endif]--><![if !vml]><img width=44 height=35 1966 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 26.png"1969 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image063.png" 1967 1970 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, are defined via a Fourier 1968 1971 expansion as</p> … … 2016 2019 o:title="" chromakey="white"/> 2017 2020 </v:shape><![endif]--><![if !vml]><img width=206 height=70 2018 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 28.png"2021 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image064.png" 2019 2022 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 2020 2023 … … 2070 2073 o:title="" chromakey="white"/> 2071 2074 </v:shape><![endif]--><![if !vml]><img width=211 height=70 2072 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 30.png"2075 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image067.png" 2073 2076 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 2074 2077 … … 2092 2095 o:title="" chromakey="white"/> 2093 2096 </v:shape><![endif]--><![if !vml]><img width=33 height=35 2094 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 32.png"2097 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image068.png" 2095 2098 v:shapes="_x0000_i1025"><![endif]></span><![endif]>.<span 2096 2099 style='mso-spacerun:yes'> </span>These Fourier coefficients are determined so … … 2219 2222 o:title="" chromakey="white"/> 2220 2223 </v:shape><![endif]--><![if !vml]><img width=565 height=74 2221 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 34.png"2224 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image069.png" 2222 2225 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 2223 2226 … … 2257 2260 o:title="" chromakey="white"/> 2258 2261 </v:shape><![endif]--><![if !vml]><img width=148 height=35 2259 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 36.png"2262 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image070.png" 2260 2263 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 2261 2264 style='mso-spacerun:yes'> </span>and <!--[if gte msEquation 12]><m:oMath><m:func><m:funcPr><span … … 2292 2295 o:title="" chromakey="white"/> 2293 2296 </v:shape><![endif]--><![if !vml]><img width=134 height=35 2294 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 38.png"2297 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image071.png" 2295 2298 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 2296 2299 style='mso-spacerun:yes'> </span>are combined depending on the symmetry and the … … 2313 2316 o:title="" chromakey="white"/> 2314 2317 </v:shape><![endif]--><![if !vml]><img width=64 height=35 2315 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 40.png"2318 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image072.png" 2316 2319 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 2317 2320 style='mso-spacerun:yes'> </span>and <!--[if gte msEquation 12]><m:oMath><m:sSubSup><m:sSubSupPr><span … … 2332 2335 o:title="" chromakey="white"/> 2333 2336 </v:shape><![endif]--><![if !vml]><img width=60 height=35 2334 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 42.png"2337 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image073.png" 2335 2338 v:shapes="_x0000_i1025"><![endif]></span><![endif]>.<span 2336 2339 style='mso-spacerun:yes'> </span>For cubic crystal symmetry, the term <!--[if gte msEquation 12]><m:oMath><m:sSubSup><m:sSubSupPr><span … … 2351 2354 o:title="" chromakey="white"/> 2352 2355 </v:shape><![endif]--><![if !vml]><img width=64 height=35 2353 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 40.png"2356 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image072.png" 2354 2357 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 2355 2358 style='mso-spacerun:yes'> </span>is obtained directly from the Fourier … … 2412 2415 o:title="" chromakey="white"/> 2413 2416 </v:shape><![endif]--><![if !vml]><img width=258 height=70 2414 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 44.png"2417 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image074.png" 2415 2418 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 2416 2419 … … 2431 2434 o:title="" chromakey="white"/> 2432 2435 </v:shape><![endif]--><![if !vml]><img width=30 height=35 2433 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 46.png"2436 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image075.png" 2434 2437 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, as tabulated by Bunge 2435 2438 (1982). </p> … … 2453 2456 o:title="" chromakey="white"/> 2454 2457 </v:shape><![endif]--><![if !vml]><img width=29 height=35 2455 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 48.png"2458 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image076.png" 2456 2459 v:shapes="_x0000_i1025"><![endif]></span><![endif]>, and the three sample 2457 2460 orientation angles, <span style='font-family:Symbol'>W</span><sub>s</sub>, <span … … 2474 2477 o:title="" chromakey="white"/> 2475 2478 </v:shape><![endif]--><![if !vml]><img width=29 height=35 2476 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 48.png"2479 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image076.png" 2477 2480 v:shapes="_x0000_i1025"><![endif]></span><![endif]><span 2478 2481 style='mso-spacerun:yes'> </span>and the sample orientation angles <span … … 2532 2535 o:title="" chromakey="white"/> 2533 2536 </v:shape><![endif]--><![if !vml]><img width=241 height=72 2534 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image0 50.png"2537 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image077.png" 2535 2538 v:shapes="_x0000_i1025"><![endif]></span><![endif]></p> 2536 2539 2537 2540 <p class=gsastext style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; 2538 margin-left:0in;line-height:115%'>If the texture is random then J = 1, otherwise 2539 J > 1; for a single crystal J = <span style='font-family:Symbol'>¥.</span> </p> 2541 margin-left:0in;line-height:115%'>If the texture is random then J = 1, 2542 otherwise J > 1; for a single crystal J = <span style='font-family:Symbol'>¥.</span> 2543 </p> 2540 2544 2541 2545 <p class=gsastext style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; 2542 2546 margin-left:0in;line-height:115%'>In GSAS-II the texture is defined in two ways 2543 to accommodate the two possible uses of this correction. In one a suite of2547 to accommodate the two possible uses of this correction. In one, a suite of 2544 2548 spherical harmonics coefficients is defined for the texture of a phase in the 2545 2549 sample; this can have any of the possible sample symmetries and is the usual 2546 2550 result desired for texture analysis. The other is the suite of spherical 2547 harmonics terms for cylindrical sample symmetry for each phase in each powder 2548 pattern (histogram) and is usually used to accommodate preferred orientation 2549 effects in a Rietveld refinement. The former description allows refinement of 2550 thesample orientation zeros, <span style='font-family:Symbol'>W</span><sub>s</sub>,2551 harmonics terms for cylindrical sample symmetry for each phase in each powder pattern 2552 (histogram) and is usually used to accommodate preferred orientation effects 2553 in a Rietveld refinement. The former description allows refinement of the 2554 sample orientation zeros, <span style='font-family:Symbol'>W</span><sub>s</sub>, 2551 2555 <span style='font-family:Symbol'>C</span><sub>s</sub>, <span style='font-family: 2552 2556 Symbol'>F</span><sub>s</sub>, but the latter description does not (they are … … 2577 2581 entries are listed in <b style='mso-bidi-font-weight:normal'><span 2578 2582 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2579 mso-hansi-theme-font:minor-latin;mso-bidi-font-family:Calibri;mso-bidi-theme-font: 2580 minor-latin'>bold face</span></b> below as <b style='mso-bidi-font-weight:normal'><span 2581 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2582 mso-hansi-theme-font:minor-latin;mso-bidi-font-family:Calibri;mso-bidi-theme-font: 2583 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>bold face</span></b> 2584 below as <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2585 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 2583 2586 minor-latin'>Help/About GSAS-II</span></b>, which lists first the name of the 2584 2587 menu (here <b style='mso-bidi-font-weight:normal'><span style='font-family: 2585 2588 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 2586 minor-latin;mso-bidi-font-family:Calibri;mso-bidi-theme-font:minor-latin'>Help</span></b>) 2587 and second the name of the entry in the menu (here <b style='mso-bidi-font-weight: 2589 minor-latin;mso-bidi-theme-font:minor-latin'>Help</span></b>) and second the 2590 name of the entry in the menu (here <b style='mso-bidi-font-weight:normal'><span 2591 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2592 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>About GSAS-II</span></b>). 2593 </p> 2594 2595 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Use the <b 2596 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2597 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Import/Image/from 2598 GE image file</span></b> menu item to read the data file into the current 2599 GSAS-II project. A file selection dialog will be shown; its appearance will 2600 depend on your OS. Change the search directory to <b style='mso-bidi-font-weight: 2588 2601 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 2589 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-font-family:Calibri; 2590 mso-bidi-theme-font:minor-latin'>About GSAS-II</span></b>). </p> 2591 2592 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Use the <b 2593 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2594 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Data/Read image 2595 data</span></b> menu item to read the data file into the current GSAS-II 2596 project. A file selection dialog will be shown; its appearance will depend on 2597 your OS. Change the search directory to <b style='mso-bidi-font-weight:normal'><span 2598 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2599 mso-hansi-theme-font:minor-latin;mso-bidi-font-family:Calibri;mso-bidi-theme-font: 2600 minor-latin'>2DTexture/data </span></b>and then select the file <b 2601 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2602 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>NDC5_01588_1.ge2</span></b>. 2603 A (faint) image will appear</p> 2604 2605 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2606 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_29" 2607 o:spid="_x0000_i1081" type="#_x0000_t75" style='width:525pt;height:450pt; 2608 visibility:visible;mso-wrap-style:square'> 2609 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image051.png" 2610 o:title=""/> 2611 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=600 2612 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image051.png" 2613 v:shapes="Picture_x0020_29"><![endif]></span></p> 2614 2615 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>and the <b 2616 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2617 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Image 2618 Controls</span></b> data page will show</p> 2619 2620 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2621 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_30" 2622 o:spid="_x0000_i1080" type="#_x0000_t75" style='width:472.5pt;height:388.5pt; 2623 visibility:visible;mso-wrap-style:square'> 2624 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image052.png" 2625 o:title=""/> 2626 </v:shape><![endif]--><![if !vml]><img border=0 width=630 height=518 2627 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image052.png" 2628 v:shapes="Picture_x0020_30"><![endif]></span></p> 2602 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>2DTexture/data 2603 </span></b>and then select the file <b style='mso-bidi-font-weight:normal'><span 2604 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2605 mso-hansi-theme-font:minor-latin'>NDC5_01588_1.ge2</span></b>. An image will 2606 appear</p> 2607 2608 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2609 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_58" 2610 o:spid="_x0000_i1081" type="#_x0000_t75" style='width:468pt;height:401.25pt; 2611 visibility:visible;mso-wrap-style:square'> 2612 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image105.png" 2613 o:title=""/> 2614 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 2615 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image078.png" 2616 v:shapes="Picture_x0020_58"><![endif]></span></p> 2617 2618 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2619 class=GramE>and</span> the <b style='mso-bidi-font-weight:normal'><span 2620 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2621 mso-hansi-theme-font:minor-latin'>Image Controls</span></b> data page will show</p> 2622 2623 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2624 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_59" 2625 o:spid="_x0000_i1080" type="#_x0000_t75" style='width:468pt;height:291.75pt; 2626 visibility:visible;mso-wrap-style:square'> 2627 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image107.png" 2628 o:title=""/> 2629 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=389 2630 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image163.png" 2631 v:shapes="Picture_x0020_59"><![endif]></span></p> 2629 2632 2630 2633 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The detector 2631 2634 was previously calibrated and the coefficients are stored in a file found by 2632 doing <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2633 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Operations/Load 2634 Controls</span></b> from the <b style='mso-bidi-font-weight:normal'><span 2635 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2636 mso-hansi-theme-font:minor-latin'>Image Controls</span></b> menu. A file 2637 selection popup will appear showing <b style='mso-bidi-font-weight:normal'><span 2638 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2639 mso-hansi-theme-font:minor-latin'>NDC5.imctrl</span></b>; select it and press <b 2640 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2641 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Open</span></b>. 2642 The <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2635 doing <span class=SpellE><b style='mso-bidi-font-weight:normal'><span 2636 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2637 mso-hansi-theme-font:minor-latin'>Parms</span></b></span><b style='mso-bidi-font-weight: 2638 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 2639 minor-latin;mso-hansi-theme-font:minor-latin'>/Load Controls</span></b> from 2640 the <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2643 2641 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Image 2644 Controls</span></b> window will be repainted with the new values (do a reselect 2645 of the image from the tree and then <b style='mso-bidi-font-weight:normal'><span 2646 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2647 mso-hansi-theme-font:minor-latin'>Image Controls</span></b> to make sure the 2648 image is up to date.)</p> 2649 2650 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2651 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_31" 2652 o:spid="_x0000_i1079" type="#_x0000_t75" style='width:472.5pt;height:388.5pt; 2653 visibility:visible;mso-wrap-style:square'> 2654 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image053.png" 2655 o:title=""/> 2656 </v:shape><![endif]--><![if !vml]><img border=0 width=630 height=518 2657 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image053.png" 2658 v:shapes="Picture_x0020_31"><![endif]></span></p> 2642 Controls</span></b> menu. A file selection popup will appear showing <b 2643 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2644 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>NDC5.imctrl</span></b>; 2645 select it and press <b style='mso-bidi-font-weight:normal'><span 2646 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2647 mso-hansi-theme-font:minor-latin'>Open</span></b>. The <b style='mso-bidi-font-weight: 2648 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 2649 minor-latin;mso-hansi-theme-font:minor-latin'>Image Controls</span></b> window 2650 will be repainted with the new values and the image will be redrawn.</p> 2651 2652 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2653 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_60" 2654 o:spid="_x0000_i1079" type="#_x0000_t75" style='width:468pt;height:291.75pt; 2655 visibility:visible;mso-wrap-style:square'> 2656 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image109.png" 2657 o:title=""/> 2658 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=389 2659 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image164.png" 2660 v:shapes="Picture_x0020_60"><![endif]></span></p> 2659 2661 2660 2662 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The detail in … … 2675 2677 2676 2678 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2677 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 32"2678 o:spid="_x0000_i1078" type="#_x0000_t75" style='width: 525pt;height:450pt;2679 visibility:visible;mso-wrap-style:square'> 2680 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 054.png"2681 o:title=""/> 2682 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6002683 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 054.png"2684 v:shapes="Picture_x0020_ 32"><![endif]></span></p>2685 2686 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>For texture 2687 analysiswe will need to integrate the image into a number of slices sampling the2679 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_61" 2680 o:spid="_x0000_i1078" type="#_x0000_t75" style='width:468pt;height:391.5pt; 2681 visibility:visible;mso-wrap-style:square'> 2682 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image111.png" 2683 o:title=""/> 2684 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=522 2685 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image165.png" 2686 v:shapes="Picture_x0020_61"><![endif]></span></p> 2687 2688 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>For texture analysis 2689 we will need to integrate the image into a number of slices sampling the 2688 2690 changing ring intensity with azimuthal angle. Also note that the image seems to 2689 2691 have <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; … … 2723 2725 2724 2726 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2725 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 33"2726 o:spid="_x0000_i1077" type="#_x0000_t75" style='width: 525pt;height:450pt;2727 visibility:visible;mso-wrap-style:square'> 2728 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 055.png"2729 o:title=""/> 2730 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6002731 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 055.png"2732 v:shapes="Picture_x0020_ 33"><![endif]></span></p>2727 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_62" 2728 o:spid="_x0000_i1077" type="#_x0000_t75" style='width:468pt;height:391.5pt; 2729 visibility:visible;mso-wrap-style:square'> 2730 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image113.png" 2731 o:title=""/> 2732 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=522 2733 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image166.png" 2734 v:shapes="Picture_x0020_62"><![endif]></span></p> 2733 2735 2734 2736 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The <b … … 2738 2740 2739 2741 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2740 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 34"2741 o:spid="_x0000_i1076" type="#_x0000_t75" style='width:4 72.5pt;height:388.5pt;2742 visibility:visible;mso-wrap-style:square'> 2743 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 056.png"2744 o:title=""/> 2745 </v:shape><![endif]--><![if !vml]><img border=0 width=6 30 height=5182746 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 056.png"2747 v:shapes="Picture_x0020_ 34"><![endif]></span></p>2742 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_63" 2743 o:spid="_x0000_i1076" type="#_x0000_t75" style='width:468pt;height:291.75pt; 2744 visibility:visible;mso-wrap-style:square'> 2745 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image115.png" 2746 o:title=""/> 2747 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=389 2748 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image167.png" 2749 v:shapes="Picture_x0020_63"><![endif]></span></p> 2748 2750 2749 2751 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>It turns out … … 2755 2757 2756 2758 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2757 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 35"2758 o:spid="_x0000_i1075" type="#_x0000_t75" style='width: 297.75pt;height:99.75pt;2759 visibility:visible;mso-wrap-style:square'> 2760 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 057.png"2761 o:title=""/> 2762 </v:shape><![endif]--><![if !vml]><img border=0 width= 397 height=1332763 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 057.png"2764 v:shapes="Picture_x0020_ 35"><![endif]></span></p>2759 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_64" 2760 o:spid="_x0000_i1075" type="#_x0000_t75" style='width:468pt;height:143.25pt; 2761 visibility:visible;mso-wrap-style:square'> 2762 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image117.png" 2763 o:title=""/> 2764 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=191 2765 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image168.png" 2766 v:shapes="Picture_x0020_64"><![endif]></span></p> 2765 2767 2766 2768 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Change the <b … … 2775 2777 2776 2778 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2777 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 36"2778 o:spid="_x0000_i1074" type="#_x0000_t75" style='width: 525pt;height:450pt;2779 visibility:visible;mso-wrap-style:square'> 2780 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 058.png"2781 o:title=""/> 2782 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6002783 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 058.png"2784 v:shapes="Picture_x0020_ 36"><![endif]></span></p>2785 2786 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> for one ring.2787 This level is too low. Return to the <b style='mso-bidi-font-weight:normal'><span 2788 style=' font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin;2789 mso- hansi-theme-font:minor-latin'>Image Controls</span></b> item in the data2790 tree.</p>2779 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_65" 2780 o:spid="_x0000_i1074" type="#_x0000_t75" style='width:468pt;height:391.5pt; 2781 visibility:visible;mso-wrap-style:square'> 2782 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image119.png" 2783 o:title=""/> 2784 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=522 2785 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image169.png" 2786 v:shapes="Picture_x0020_65"><![endif]></span></p> 2787 2788 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2789 class=GramE>for</span> one ring. This level is too low. Return to the <b 2790 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2791 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Image 2792 Controls</span></b> item in the data tree.</p> 2791 2793 2792 2794 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>We are now 2793 2795 ready to integrate the image; do <b style='mso-bidi-font-weight:normal'><span 2794 2796 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2795 mso-hansi-theme-font:minor-latin'> Operations/Integrate</span></b> from the <b2797 mso-hansi-theme-font:minor-latin'>Integration/Integrate</span></b> from the <b 2796 2798 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2797 2799 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Image … … 2800 2802 2801 2803 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2802 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 37"2803 o:spid="_x0000_i1073" type="#_x0000_t75" style='width: 525pt;height:450pt;2804 visibility:visible;mso-wrap-style:square'> 2805 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 059.png"2806 o:title=""/> 2807 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6002808 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 059.png"2809 v:shapes="Picture_x0020_ 37"><![endif]></span></p>2804 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_66" 2805 o:spid="_x0000_i1073" type="#_x0000_t75" style='width:468pt;height:391.5pt; 2806 visibility:visible;mso-wrap-style:square'> 2807 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image121.png" 2808 o:title=""/> 2809 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=522 2810 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image170.png" 2811 v:shapes="Picture_x0020_66"><![endif]></span></p> 2810 2812 2811 2813 <h2 style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt;margin-left: … … 2847 2849 mso-hansi-theme-font:minor-latin'>0.005</span></b> for both.<br> 2848 2850 Use the <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2849 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Data/Add 2851 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Data/Add new 2850 2852 phase</span></b> to enter the <b style='mso-bidi-font-weight:normal'><span 2851 2853 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; … … 2863 2865 minor-latin'>Atoms</span></b> tab begin by doing <b style='mso-bidi-font-weight: 2864 2866 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 2865 minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Append atom</span></b> twice2866 t hen fill in the <b style='mso-bidi-font-weight:normal'><span style='font-family:2867 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 2868 m inor-latin'>Type</span></b> and coordinates boxes. A double click of the <b2869 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2870 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Type</span></b> 2871 entry will show a popup of the Periodic Table; select the element as 2872 appropriate. NB: GSAS-II happily takes 1/2 & 1/4 for coordinate values; 2873 t hese get converted to their decimal equivalent upon entry. Note the use of a2874 nonstandard space group designation for B19. When done the B2 Atoms table 2875 should look like</p>2876 2877 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2878 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 38"2879 o:spid="_x0000_i1072" type="#_x0000_t75" style='width: 525pt;height:166.5pt;2880 visibility:visible;mso-wrap-style:square'> 2881 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 060.png"2882 o:title=""/> 2883 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=2222884 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 060.png"2885 v:shapes="Picture_x0020_ 38"><![endif]></span></p>2886 2887 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> and the B192888 Atoms table should be</p>2889 2890 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2891 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 39"2892 o:spid="_x0000_i1071" type="#_x0000_t75" style='width: 525pt;height:163.5pt;2893 visibility:visible;mso-wrap-style:square'> 2894 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 061.png"2895 o:title=""/> 2896 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=2182897 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 061.png"2898 v:shapes="Picture_x0020_ 39"><![endif]></span></p>2867 minor-latin;mso-hansi-theme-font:minor-latin'>Edit Atoms/Append atom</span></b> 2868 twice then fill in the <b style='mso-bidi-font-weight:normal'><span 2869 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2870 mso-hansi-theme-font:minor-latin'>Type</span></b> and coordinates boxes. A 2871 double click of the <b style='mso-bidi-font-weight:normal'><span 2872 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2873 mso-hansi-theme-font:minor-latin'>Type</span></b> entry will show a popup of 2874 the Periodic Table; select the element as appropriate. NB: GSAS-II happily 2875 takes 1/2 & 1/4 for coordinate values; these get converted to their 2876 decimal equivalent upon entry. Note the use of a nonstandard space group 2877 designation for B19. When done the B2 Atoms table should look like</p> 2878 2879 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2880 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_68" 2881 o:spid="_x0000_i1072" type="#_x0000_t75" style='width:468pt;height:132pt; 2882 visibility:visible;mso-wrap-style:square'> 2883 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image123.png" 2884 o:title=""/> 2885 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=176 2886 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image171.png" 2887 v:shapes="Picture_x0020_68"><![endif]></span></p> 2888 2889 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2890 class=GramE>and</span> the B19 Atoms table should be</p> 2891 2892 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2893 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_69" 2894 o:spid="_x0000_i1071" type="#_x0000_t75" style='width:468pt;height:132pt; 2895 visibility:visible;mso-wrap-style:square'> 2896 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image125.png" 2897 o:title=""/> 2898 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=176 2899 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image172.png" 2900 v:shapes="Picture_x0020_69"><![endif]></span></p> 2899 2901 2900 2902 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Next go to the … … 2903 2905 tab for each phase; there will be a message indicating the lack of data for 2904 2906 each. Do <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2905 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Add2907 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Add 2906 2908 powder histograms</span></b>, do <b style='mso-bidi-font-weight:normal'><span 2907 2909 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; … … 2912 2914 2913 2915 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2914 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 40"2915 o:spid="_x0000_i1070" type="#_x0000_t75" style='width: 342.75pt;height:375pt;2916 visibility:visible;mso-wrap-style:square'> 2917 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 062.png"2918 o:title=""/> 2919 </v:shape><![endif]--><![if !vml]><img border=0 width= 457 height=5002920 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 062.png"2921 v:shapes="Picture_x0020_ 40"><![endif]></span></p>2922 2923 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> and that for2924 B19 will be</p>2925 2926 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2927 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 41"2928 o:spid="_x0000_i1069" type="#_x0000_t75" style='width: 370.5pt;height:375pt;2929 visibility:visible;mso-wrap-style:square'> 2930 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 063.png"2931 o:title=""/> 2932 </v:shape><![endif]--><![if !vml]><img border=0 width= 494 height=5002933 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 063.png"2934 v:shapes="Picture_x0020_ 41"><![endif]></span></p>2916 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_70" 2917 o:spid="_x0000_i1070" type="#_x0000_t75" style='width:468pt;height:325.5pt; 2918 visibility:visible;mso-wrap-style:square'> 2919 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image127.png" 2920 o:title=""/> 2921 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=434 2922 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image173.png" 2923 v:shapes="Picture_x0020_70"><![endif]></span></p> 2924 2925 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2926 class=GramE>and</span> that for B19 will be</p> 2927 2928 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 2929 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_71" 2930 o:spid="_x0000_i1069" type="#_x0000_t75" style='width:468pt;height:341.25pt; 2931 visibility:visible;mso-wrap-style:square'> 2932 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image129.png" 2933 o:title=""/> 2934 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=455 2935 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image174.png" 2936 v:shapes="Picture_x0020_71"><![endif]></span></p> 2935 2937 2936 2938 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>You should now … … 2999 3001 varying the phase fractions instead.</p> 3000 3002 3001 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Next select 3002 theB2 phase and pick the Data tab; you will see</p>3003 3004 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3005 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 42"3006 o:spid="_x0000_i1068" type="#_x0000_t75" style='width: 342.75pt;height:375pt;3007 visibility:visible;mso-wrap-style:square'> 3008 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 062.png"3009 o:title=""/> 3010 </v:shape><![endif]--><![if !vml]><img border=0 width= 457 height=5003011 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 062.png"3012 v:shapes="Picture_x0020_ 42"><![endif]></span></p>3003 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Next select the 3004 B2 phase and pick the Data tab; you will see</p> 3005 3006 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3007 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_72" 3008 o:spid="_x0000_i1068" type="#_x0000_t75" style='width:468pt;height:353.25pt; 3009 visibility:visible;mso-wrap-style:square'> 3010 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image131.png" 3011 o:title=""/> 3012 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=471 3013 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image175.png" 3014 v:shapes="Picture_x0020_72"><![endif]></span></p> 3013 3015 3014 3016 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Select the <b … … 3017 3019 fraction</span></b> box. Then do <b style='mso-bidi-font-weight:normal'><span 3018 3020 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3019 mso-hansi-theme-font:minor-latin'>Edit/Copy data</span></b>, select <b 3020 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3021 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Set All</span></b> 3022 & press <b style='mso-bidi-font-weight:normal'><span style='font-family: 3023 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3024 minor-latin'>OK</span></b> to copy these to the other histograms. Next select 3025 the <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3026 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>B19</span></b> 3027 phase and repeat this process. We are now ready for the first refinement; do <b 3028 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3029 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Calculate/Refine</span></b> 3030 from the main GSAS-II data tree window. A progress bar popup will appear and 3031 when done a <b style='mso-bidi-font-weight:normal'><span style='font-family: 3032 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3033 minor-latin'>Refinement results</span></b> popup will show with Rw~32%. Press <b 3034 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3035 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>OK</span></b> 3036 to load this result; GSAS-II will return you to the last window you were using 3037 and display the 1<sup>st</sup> powder pattern showing you the fit</p> 3038 3039 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3040 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_43" 3041 o:spid="_x0000_i1067" type="#_x0000_t75" style='width:525pt;height:450pt; 3042 visibility:visible;mso-wrap-style:square'> 3043 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image064.png" 3044 o:title=""/> 3045 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=600 3046 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image064.png" 3047 v:shapes="Picture_x0020_43"><![endif]></span></p> 3021 mso-hansi-theme-font:minor-latin'>Edit Phase/Copy data</span></b>, select <b 3022 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3023 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Set <span 3024 class=GramE>All</span></span></b> & press <b style='mso-bidi-font-weight: 3025 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3026 minor-latin;mso-hansi-theme-font:minor-latin'>OK</span></b> to copy these to 3027 the other histograms. Next select the <b style='mso-bidi-font-weight:normal'><span 3028 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3029 mso-hansi-theme-font:minor-latin'>B19</span></b> phase and repeat this 3030 process. We are now ready for the first refinement; do <b style='mso-bidi-font-weight: 3031 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3032 minor-latin;mso-hansi-theme-font:minor-latin'>Calculate/Refine</span></b> from 3033 the main GSAS-II data tree window. A progress bar popup will appear and when 3034 done a <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3035 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Refinement 3036 results</span></b> popup will show with Rw~32%. Press <b style='mso-bidi-font-weight: 3037 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3038 minor-latin;mso-hansi-theme-font:minor-latin'>OK</span></b> to load this 3039 result; GSAS-II will return you to the last window you were using and display 3040 (NB: pick the 1<sup>st</sup> PWDR entry) the 1<sup>st</sup> powder pattern 3041 showing you the fit</p> 3042 3043 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3044 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_73" 3045 o:spid="_x0000_i1067" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3046 visibility:visible;mso-wrap-style:square'> 3047 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image133.png" 3048 o:title=""/> 3049 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3050 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image176.png" 3051 v:shapes="Picture_x0020_73"><![endif]></span></p> 3048 3052 3049 3053 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This is quite 3050 3054 poor. You can survey the fit successively by 1<sup>st</sup> selecting say the 1<sup>st</sup> 3051 3055 PWDR entry from the tree and then using the up/down arrow keys to step to the 3052 next one; the plot will redraw at each step (NB: at full scale) and the data 3053 window will show statistics of the fit. There is a substantial intensity 3054 discrepancy; this is due to the texture. It is also evident that some of the 3055 peaks are out of place relative to the reflection markers; this is due to 3056 macroscopic strain in the drawn wire. For the <span style='font-family:"Calibri",sans-serif; 3057 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>B2</span> 3058 phase select the <b style='mso-bidi-font-weight:normal'><span style='font-family: 3059 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3060 minor-latin'>Texture</span></b> tab; it should look like</p> 3061 3062 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3063 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_44" 3064 o:spid="_x0000_i1066" type="#_x0000_t75" style='width:456pt;height:217.5pt; 3065 visibility:visible;mso-wrap-style:square'> 3066 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image065.png" 3067 o:title=""/> 3068 </v:shape><![endif]--><![if !vml]><img border=0 width=608 height=290 3069 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image065.png" 3070 v:shapes="Picture_x0020_44"><![endif]></span></p> 3056 next one; the plot will redraw at each step (NB: at the same scale as the 1<sup>st</sup> 3057 one selected) and the data window will show statistics of the fit. There is a 3058 substantial intensity discrepancy; this is due to the texture. It is also 3059 evident that some of the peaks are out of place relative to the reflection 3060 markers; this is due to macroscopic strain in the drawn wire. For the <span 3061 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3062 mso-hansi-theme-font:minor-latin'>B2</span> phase select the <b 3063 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3064 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Texture</span></b> 3065 tab; it should look like</p> 3066 3067 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3068 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_74" 3069 o:spid="_x0000_i1066" type="#_x0000_t75" style='width:468pt;height:164.25pt; 3070 visibility:visible;mso-wrap-style:square'> 3071 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image135.png" 3072 o:title=""/> 3073 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=219 3074 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image177.png" 3075 v:shapes="Picture_x0020_74"><![endif]></span></p> 3071 3076 3072 3077 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The texture … … 3086 3091 3087 3092 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3088 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 45"3089 o:spid="_x0000_i1065" type="#_x0000_t75" style='width:4 56pt;height:250.5pt;3090 visibility:visible;mso-wrap-style:square'> 3091 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 066.png"3092 o:title=""/> 3093 </v:shape><![endif]--><![if !vml]><img border=0 width=6 08 height=3343094 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 066.png"3095 v:shapes="Picture_x0020_ 45"><![endif]></span></p>3093 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_75" 3094 o:spid="_x0000_i1065" type="#_x0000_t75" style='width:468pt;height:174pt; 3095 visibility:visible;mso-wrap-style:square'> 3096 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image137.png" 3097 o:title=""/> 3098 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=232 3099 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image178.png" 3100 v:shapes="Picture_x0020_75"><![endif]></span></p> 3096 3101 3097 3102 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Then go to the … … 3106 3111 3107 3112 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3108 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 46"3109 o:spid="_x0000_i1064" type="#_x0000_t75" style='width: 342.75pt;height:375pt;3110 visibility:visible;mso-wrap-style:square'> 3111 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 067.png"3112 o:title=""/> 3113 </v:shape><![endif]--><![if !vml]><img border=0 width= 457 height=5003114 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 067.png"3115 v:shapes="Picture_x0020_ 46"><![endif]></span></p>3113 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_76" 3114 o:spid="_x0000_i1064" type="#_x0000_t75" style='width:468pt;height:240.75pt; 3115 visibility:visible;mso-wrap-style:square'> 3116 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image139.png" 3117 o:title=""/> 3118 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=321 3119 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image179.png" 3120 v:shapes="Picture_x0020_76"><![endif]></span></p> 3116 3121 3117 3122 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Then do <b 3118 3123 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3119 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy3124 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3120 3125 flags</span></b> to have <b style='mso-bidi-font-weight:normal'><span 3121 3126 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; … … 3136 3141 3137 3142 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3138 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 47"3139 o:spid="_x0000_i1063" type="#_x0000_t75" style='width:4 78.5pt;height:302.25pt;3140 visibility:visible;mso-wrap-style:square'> 3141 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 068.png"3142 o:title=""/> 3143 </v:shape><![endif]--><![if !vml]><img border=0 width=6 38 height=4033144 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 068.png"3145 v:shapes="Picture_x0020_ 47"><![endif]></span></p>3143 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_77" 3144 o:spid="_x0000_i1063" type="#_x0000_t75" style='width:468pt;height:227.25pt; 3145 visibility:visible;mso-wrap-style:square'> 3146 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image141.png" 3147 o:title=""/> 3148 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=303 3149 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image180.png" 3150 v:shapes="Picture_x0020_77"><![endif]></span></p> 3146 3151 3147 3152 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Then go to the … … 3155 3160 boxes and do <b style='mso-bidi-font-weight:normal'><span style='font-family: 3156 3161 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3157 minor-latin'>Edit /Copy flags</span></b> as before. The tab will look like</p>3158 3159 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3160 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 48"3161 o:spid="_x0000_i1062" type="#_x0000_t75" style='width: 370.5pt;height:375pt;3162 visibility:visible;mso-wrap-style:square'> 3163 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 069.png"3164 o:title=""/> 3165 </v:shape><![endif]--><![if !vml]><img border=0 width= 494 height=5003166 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 069.png"3167 v:shapes="Picture_x0020_ 48"><![endif]></span></p>3162 minor-latin'>Edit Phase/Copy flags</span></b> as before. The tab will look like</p> 3163 3164 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3165 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_78" 3166 o:spid="_x0000_i1062" type="#_x0000_t75" style='width:468pt;height:270pt; 3167 visibility:visible;mso-wrap-style:square'> 3168 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image143.png" 3169 o:title=""/> 3170 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=360 3171 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image181.png" 3172 v:shapes="Picture_x0020_78"><![endif]></span></p> 3168 3173 3169 3174 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Now do <b … … 3174 3179 3175 3180 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3176 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 49"3177 o:spid="_x0000_i1061" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3178 visibility:visible;mso-wrap-style:square'> 3179 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 070.png"3180 o:title=""/> 3181 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513182 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 070.png"3183 v:shapes="Picture_x0020_ 49"><![endif]></span></p>3181 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_79" 3182 o:spid="_x0000_i1061" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3183 visibility:visible;mso-wrap-style:square'> 3184 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image145.png" 3185 o:title=""/> 3186 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3187 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image182.png" 3188 v:shapes="Picture_x0020_79"><![endif]></span></p> 3184 3189 3185 3190 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The calculated … … 3194 3199 mso-hansi-theme-font:minor-latin'>microstrain</span></b></span> box. Then do <b 3195 3200 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3196 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy3201 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3197 3202 flags</span></b> to set it for the other PWDR data sets. Do the same for the <b 3198 3203 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; … … 3201 3206 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3202 3207 minor-latin'>Calculate/Refine</span></b> from the main menu. The fit will be 3203 substantially improved with <span class=SpellE>Rw</span> ~ 9.2%.</p>3208 substantially improved with <span class=SpellE>Rw</span> ~10%.</p> 3204 3209 3205 3210 <h3 style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt;margin-left: … … 3210 3215 3211 3216 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3212 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 50"3213 o:spid="_x0000_i1060" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3214 visibility:visible;mso-wrap-style:square'> 3215 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 071.png"3216 o:title=""/> 3217 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513218 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 071.png"3219 v:shapes="Picture_x0020_ 50"><![endif]></span></p>3217 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_80" 3218 o:spid="_x0000_i1060" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3219 visibility:visible;mso-wrap-style:square'> 3220 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image147.png" 3221 o:title=""/> 3222 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3223 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image183.png" 3224 v:shapes="Picture_x0020_80"><![endif]></span></p> 3220 3225 3221 3226 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>It is evident … … 3225 3230 3226 3231 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3227 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 18"3228 o:spid="_x0000_i1059" type="#_x0000_t75" style='width:4 56pt;height:250.5pt;3229 visibility:visible;mso-wrap-style:square'> 3230 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 072.png"3231 o:title=""/> 3232 </v:shape><![endif]--><![if !vml]><img border=0 width=6 08 height=3343233 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 072.png"3234 v:shapes="Picture_x0020_ 18"><![endif]></span></p>3232 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_81" 3233 o:spid="_x0000_i1059" type="#_x0000_t75" style='width:468pt;height:192.75pt; 3234 visibility:visible;mso-wrap-style:square'> 3235 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image149.png" 3236 o:title=""/> 3237 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=257 3238 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image184.png" 3239 v:shapes="Picture_x0020_81"><![endif]></span></p> 3235 3240 3236 3241 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>And a drawing … … 3240 3245 3241 3246 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3242 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 52"3243 o:spid="_x0000_i1058" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3244 visibility:visible;mso-wrap-style:square'> 3245 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 073.png"3246 o:title=""/> 3247 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513248 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 073.png"3249 v:shapes="Picture_x0020_ 52"><![endif]></span></p>3247 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_82" 3248 o:spid="_x0000_i1058" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3249 visibility:visible;mso-wrap-style:square'> 3250 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image151.png" 3251 o:title=""/> 3252 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3253 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image185.png" 3254 v:shapes="Picture_x0020_82"><![endif]></span></p> 3250 3255 3251 3256 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This shows the … … 3259 3264 3260 3265 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3261 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 53"3262 o:spid="_x0000_i1057" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3263 visibility:visible;mso-wrap-style:square'> 3264 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 074.png"3265 o:title=""/> 3266 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513267 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 074.png"3268 v:shapes="Picture_x0020_ 53"><![endif]></span></p>3266 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_83" 3267 o:spid="_x0000_i1057" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3268 visibility:visible;mso-wrap-style:square'> 3269 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image153.png" 3270 o:title=""/> 3271 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3272 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image186.png" 3273 v:shapes="Picture_x0020_83"><![endif]></span></p> 3269 3274 3270 3275 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This phase is … … 3272 3277 direction. Again we want to increment the Harmonic order to the next higher 3273 3278 level (8). Again do Calculate/Refine from the main menu; the <span 3274 class=SpellE>Rwp</span> has dropped to ~ 7.9%. One can add the atom <span3279 class=SpellE>Rwp</span> has dropped to ~8.9%. One can add the atom <span 3275 3280 class=SpellE>Uiso</span> for the Ni and <span class=SpellE>Ti</span> atoms in 3276 3281 the B2 phase and the coordinates and <span class=SpellE>Uiso</span> for the 3277 B19 phase. The <span class=SpellE>Rw</span> drops a bit further to ~ 7.4%.3282 B19 phase. The <span class=SpellE>Rw</span> drops a bit further to ~8.4%. 3278 3283 Finally, we can increase the harmonic order again for the B19 phase (it is 3279 3284 very strongly textured!) to 10 and the B2 phase to 12; the final refinement 3280 converged to <span class=SpellE>Rw</span> ~ 6.8% and the B19 inverse pole3285 converged to <span class=SpellE>Rw</span> ~7.8% and the B19 inverse pole 3281 3286 figure has peaks at ~18 MRD (Multiple of Random Distribution) and the B2 phase 3282 3287 peaks are ~7MRD.</p> … … 3286 3291 3287 3292 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3288 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 54"3289 o:spid="_x0000_i1056" type="#_x0000_t75" style='width: 502.5pt;height:375pt;3290 visibility:visible;mso-wrap-style:square'> 3291 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 075.png"3292 o:title=""/> 3293 </v:shape><![endif]--><![if !vml]><img border=0 width=6 70 height=5003294 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 075.png"3295 v:shapes="Picture_x0020_ 54"><![endif]></span></p>3296 3297 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> and inverse3298 pole figure</p>3299 3300 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3301 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 55"3302 o:spid="_x0000_i1055" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3303 visibility:visible;mso-wrap-style:square'> 3304 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 076.png"3305 o:title=""/> 3306 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513307 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 076.png"3308 v:shapes="Picture_x0020_ 55"><![endif]></span></p>3293 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_84" 3294 o:spid="_x0000_i1056" type="#_x0000_t75" style='width:468pt;height:237.75pt; 3295 visibility:visible;mso-wrap-style:square'> 3296 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image155.png" 3297 o:title=""/> 3298 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=317 3299 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image187.png" 3300 v:shapes="Picture_x0020_84"><![endif]></span></p> 3301 3302 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3303 class=GramE>and</span> inverse pole figure</p> 3304 3305 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3306 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_85" 3307 o:spid="_x0000_i1055" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3308 visibility:visible;mso-wrap-style:square'> 3309 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image157.png" 3310 o:title=""/> 3311 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3312 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image188.png" 3313 v:shapes="Picture_x0020_85"><![endif]></span></p> 3309 3314 3310 3315 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The B2 … … 3312 3317 3313 3318 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3314 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 56"3315 o:spid="_x0000_i1054" type="#_x0000_t75" style='width:4 80pt;height:267.75pt;3316 visibility:visible;mso-wrap-style:square'> 3317 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 077.png"3318 o:title=""/> 3319 </v:shape><![endif]--><![if !vml]><img border=0 width=6 40 height=3573320 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 077.png"3321 v:shapes="Picture_x0020_ 56"><![endif]></span></p>3322 3323 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> and inverse3324 pole figure</p>3325 3326 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3327 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 57"3328 o:spid="_x0000_i1053" type="#_x0000_t75" style='width: 525pt;height:413.25pt;3329 visibility:visible;mso-wrap-style:square'> 3330 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 078.png"3331 o:title=""/> 3332 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=5513333 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 078.png"3334 v:shapes="Picture_x0020_ 57"><![endif]></span></p>3319 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_86" 3320 o:spid="_x0000_i1054" type="#_x0000_t75" style='width:468pt;height:168pt; 3321 visibility:visible;mso-wrap-style:square'> 3322 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image159.png" 3323 o:title=""/> 3324 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=224 3325 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image189.png" 3326 v:shapes="Picture_x0020_86"><![endif]></span></p> 3327 3328 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3329 class=GramE>and</span> inverse pole figure</p> 3330 3331 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3332 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_87" 3333 o:spid="_x0000_i1053" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3334 visibility:visible;mso-wrap-style:square'> 3335 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image161.png" 3336 o:title=""/> 3337 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3338 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image190.png" 3339 v:shapes="Picture_x0020_87"><![endif]></span></p> 3335 3340 3336 3341 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This completes … … 3350 3355 3351 3356 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This begins 3352 the texture analysis in much the same way as Method A except that all the initial3353 refinements are done sequentially, that is refinements are done for the 3354 parameters associated with each powder pattern to convergence in a serial3357 the texture analysis in much the same way as Method A except that all the 3358 initial refinements are done sequentially, that is refinements are done for 3359 the parameters associated with each powder pattern to convergence in a serial 3355 3360 fashion. In this case where there are 10 PWDR data sets, there will be 10 3356 3361 refinements done in sequence. Parameters that span all the data (e.g. lattice … … 3411 3416 mso-hansi-theme-font:minor-latin'>Spherical harmonics</span></b>. Then do <b 3412 3417 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3413 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy3418 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3414 3419 data</span></b> to copy both the flag and the model to the other PWDR entries.</p> 3415 3420 … … 3431 3436 mso-hansi-theme-font:minor-latin'>Spherical harmonics</span></b>. Then do <b 3432 3437 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3433 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy3438 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3434 3439 data</span></b> to copy both the flag and the model to the other PWDR entries.</p> 3435 3440 … … 3440 3445 3441 3446 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3442 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 1"3443 o:spid="_x0000_i1052" type="#_x0000_t75" style='width: 330.75pt;height:153.75pt;3444 visibility:visible;mso-wrap-style:square'> 3445 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 079.png"3446 o:title=""/> 3447 </v:shape><![endif]--><![if !vml]><img border=0 width= 441 height=2053448 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 079.png"3449 v:shapes="Picture_x0020_ 1"><![endif]></span></p>3447 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_88" 3448 o:spid="_x0000_i1052" type="#_x0000_t75" style='width:468pt;height:143.25pt; 3449 visibility:visible;mso-wrap-style:square'> 3450 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image191.png" 3451 o:title=""/> 3452 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=191 3453 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image192.png" 3454 v:shapes="Picture_x0020_88"><![endif]></span></p> 3450 3455 3451 3456 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Press the <b … … 3465 3470 3466 3471 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3467 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 2"3468 o:spid="_x0000_i1051" type="#_x0000_t75" style='width: 330.75pt;height:163.5pt;3469 visibility:visible;mso-wrap-style:square'> 3470 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 080.png"3471 o:title=""/> 3472 </v:shape><![endif]--><![if !vml]><img border=0 width= 441 height=2183473 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 080.png"3474 v:shapes="Picture_x0020_ 2"><![endif]></span></p>3472 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_89" 3473 o:spid="_x0000_i1051" type="#_x0000_t75" style='width:468pt;height:149.25pt; 3474 visibility:visible;mso-wrap-style:square'> 3475 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image193.png" 3476 o:title=""/> 3477 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=199 3478 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image194.png" 3479 v:shapes="Picture_x0020_89"><![endif]></span></p> 3475 3480 3476 3481 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>You have the … … 3495 3500 3496 3501 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3497 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 3"3498 o:spid="_x0000_i1050" type="#_x0000_t75" style='width: 525pt;height:262.5pt;3499 visibility:visible;mso-wrap-style:square'> 3500 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 081.png"3501 o:title=""/> 3502 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=3503503 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 081.png"3504 v:shapes="Picture_x0020_ 3"><![endif]></span></p>3502 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_90" 3503 o:spid="_x0000_i1050" type="#_x0000_t75" style='width:468pt;height:132pt; 3504 visibility:visible;mso-wrap-style:square'> 3505 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image195.png" 3506 o:title=""/> 3507 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=176 3508 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image196.png" 3509 v:shapes="Picture_x0020_90"><![endif]></span></p> 3505 3510 3506 3511 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>There is a row … … 3516 3521 3517 3522 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3518 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 4"3519 o:spid="_x0000_i1049" type="#_x0000_t75" style='width: 525pt;height:450pt;3520 visibility:visible;mso-wrap-style:square'> 3521 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 082.png"3522 o:title=""/> 3523 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6003524 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 082.png"3525 v:shapes="Picture_x0020_ 4"><![endif]></span></p>3523 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_91" 3524 o:spid="_x0000_i1049" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3525 visibility:visible;mso-wrap-style:square'> 3526 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image197.png" 3527 o:title=""/> 3528 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3529 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image198.png" 3530 v:shapes="Picture_x0020_91"><![endif]></span></p> 3526 3531 3527 3532 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>To set these … … 3538 3543 v:shapes="Picture_x0020_5"><![endif]></span></p> 3539 3544 3540 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Check the D11 3541 box under Hydrostatic/elastic strain, set the Harmonic order to 6 and check the 3542 Refine box for it (Preferred orientation). Then in two steps, do Edit/Copy 3543 flags and Set All for the file selection. Then do Edit/Copy selected data; that 3544 will bring up a new popup</p> 3545 3546 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3547 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_6" 3548 o:spid="_x0000_i1047" type="#_x0000_t75" style='width:240pt;height:232.5pt; 3549 visibility:visible;mso-wrap-style:square'> 3550 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image084.png" 3551 o:title=""/> 3552 </v:shape><![endif]--><![if !vml]><img border=0 width=320 height=310 3553 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image084.png" 3554 v:shapes="Picture_x0020_6"><![endif]></span></p> 3545 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Check the <b 3546 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3547 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3548 minor-latin'>D11</span></b> box under Hydrostatic/elastic strain, set the <b 3549 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3550 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3551 minor-latin'>Harmonic order</span></b> to <b style='mso-bidi-font-weight:normal'><span 3552 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3553 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>6</span></b> 3554 and check the <b style='mso-bidi-font-weight:normal'><span style='font-family: 3555 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3556 minor-latin;mso-bidi-theme-font:minor-latin'>Refine</span></b> box for it 3557 (Preferred orientation). Then in two steps, do <b style='mso-bidi-font-weight: 3558 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3559 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Edit 3560 Phase/Copy flags</span></b> and <b style='mso-bidi-font-weight:normal'><span 3561 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3562 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Set All</span></b> 3563 for the file selection. Then do <b style='mso-bidi-font-weight:normal'><span 3564 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3565 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Edit Phase/Copy 3566 selected data</span></b>; that will bring up a new popup</p> 3567 3568 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3569 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_92" 3570 o:spid="_x0000_i1047" type="#_x0000_t75" style='width:241.5pt;height:292.5pt; 3571 visibility:visible;mso-wrap-style:square'> 3572 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image199.png" 3573 o:title=""/> 3574 </v:shape><![endif]--><![if !vml]><img border=0 width=322 height=390 3575 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image199.png" 3576 v:shapes="Picture_x0020_92"><![endif]></span></p> 3555 3577 3556 3578 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This allows 3557 you to select which parameters to copy data and flags. Select Pref. Ori. And 3558 press OK; the file selection is next. Do Set All and OK to do this copy. That 3559 copies the full spherical harmonics model to the other data sets. Select one to 3560 check if youd like.</p> 3579 you to select which parameters to copy data and flags. Select <b 3580 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3581 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3582 minor-latin'>Pref. Ori.</span></b> And press <b style='mso-bidi-font-weight: 3583 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3584 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>OK</span></b>; 3585 the file selection is next. Do <b style='mso-bidi-font-weight:normal'><span 3586 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3587 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Set <span 3588 class=GramE>All</span></span></b> and <b style='mso-bidi-font-weight:normal'><span 3589 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3590 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>OK</span></b> 3591 to do this copy. That copies the full spherical harmonics model to the other 3592 data sets. Select one to check if youd like.</p> 3561 3593 3562 3594 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Next do the 3563 same thing for the B19 phase; here there are 4 <span class=SpellE>Dij</span> 3564 parameters to check (do all of them) and use spherical harmonics order 4. When 3565 done that Data window will look like</p> 3566 3567 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3568 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_7" 3569 o:spid="_x0000_i1046" type="#_x0000_t75" style='width:381pt;height:467.25pt; 3570 visibility:visible;mso-wrap-style:square'> 3571 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image085.png" 3572 o:title=""/> 3573 </v:shape><![endif]--><![if !vml]><img border=0 width=508 height=623 3574 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image085.png" 3575 v:shapes="Picture_x0020_7"><![endif]></span></p> 3595 same thing for the B19 phase; here there are 4 <span class=SpellE><b 3596 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3597 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3598 minor-latin'>Dij</span></b></span><b style='mso-bidi-font-weight:normal'><span 3599 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3600 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'> </span></b>parameters 3601 to check (do all of them) and use spherical harmonics order <b 3602 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3603 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3604 minor-latin'>4</span></b>. When done that Data window will look like</p> 3605 3606 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3607 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_93" 3608 o:spid="_x0000_i1046" type="#_x0000_t75" style='width:468pt;height:315.75pt; 3609 visibility:visible;mso-wrap-style:square'> 3610 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image200.png" 3611 o:title=""/> 3612 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=421 3613 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image201.png" 3614 v:shapes="Picture_x0020_93"><![endif]></span></p> 3576 3615 3577 3616 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>We are now 3578 ready for the next refinement; do Calculate/Sequential refine. Be careful not 3579 (by habit say) pick Refine; a warning popup will appear. After it completes the 3580 Sequential refinement results shows that the fit is better but convergence wasnt 3581 quite complete.</p> 3582 3583 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3584 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_8" 3585 o:spid="_x0000_i1045" type="#_x0000_t75" style='width:525pt;height:262.5pt; 3586 visibility:visible;mso-wrap-style:square'> 3587 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image086.png" 3588 o:title=""/> 3589 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=350 3590 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image086.png" 3591 v:shapes="Picture_x0020_8"><![endif]></span></p> 3617 ready for the next refinement; do <b style='mso-bidi-font-weight:normal'><span 3618 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3619 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Calculate/Sequential 3620 refine</span></b>. Be careful not (by habit say) pick Refine; a warning popup 3621 will appear. After it completes the Sequential refinement results shows that 3622 the fit is better but convergence wasnt quite complete.</p> 3623 3624 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3625 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_95" 3626 o:spid="_x0000_i1045" type="#_x0000_t75" style='width:468pt;height:153pt; 3627 visibility:visible;mso-wrap-style:square'> 3628 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image202.png" 3629 o:title=""/> 3630 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3631 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image203.png" 3632 v:shapes="Picture_x0020_95"><![endif]></span></p> 3592 3633 3593 3634 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>It is probably … … 3596 3637 3597 3638 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3598 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_9 "3599 o:spid="_x0000_i1044" type="#_x0000_t75" style='width: 525pt;height:450pt;3600 visibility:visible;mso-wrap-style:square'> 3601 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 087.png"3602 o:title=""/> 3603 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6003604 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 087.png"3605 v:shapes="Picture_x0020_9 "><![endif]></span></p>3639 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_96" 3640 o:spid="_x0000_i1044" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3641 visibility:visible;mso-wrap-style:square'> 3642 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image204.png" 3643 o:title=""/> 3644 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3645 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image205.png" 3646 v:shapes="Picture_x0020_96"><![endif]></span></p> 3606 3647 3607 3648 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>As our 3608 3649 experience in Method A, the calculated peaks are too sharp. We need to vary the 3609 3650 <span class=SpellE>mustrain</span> parameters for both phases. Go to the Data 3610 tab for each phase, check the <span class=SpellE>microstrain</span> box and do 3611 Edit/Copy flags for all the data sets. Then do another Calculate/Sequential 3612 refine. My Sequential refinement results showed great improvement but 3613 incomplete refinement</p> 3614 3615 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3616 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_10" 3617 o:spid="_x0000_i1043" type="#_x0000_t75" style='width:525pt;height:262.5pt; 3618 visibility:visible;mso-wrap-style:square'> 3619 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image088.png" 3620 o:title=""/> 3621 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=350 3622 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image088.png" 3623 v:shapes="Picture_x0020_10"><![endif]></span></p> 3651 tab for each phase, check the <span class=SpellE><b style='mso-bidi-font-weight: 3652 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3653 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>microstrain</span></b></span> 3654 box and do <b style='mso-bidi-font-weight:normal'><span style='font-family: 3655 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3656 minor-latin;mso-bidi-theme-font:minor-latin'>Edit Phase/Copy flags</span></b> 3657 for all the data sets. Then do another <b style='mso-bidi-font-weight:normal'><span 3658 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3659 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Calculate/Sequential 3660 refine</span></b>. My Sequential refinement results showed great improvement 3661 but incomplete refinement</p> 3662 3663 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3664 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_97" 3665 o:spid="_x0000_i1043" type="#_x0000_t75" style='width:468pt;height:153pt; 3666 visibility:visible;mso-wrap-style:square'> 3667 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image206.png" 3668 o:title=""/> 3669 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3670 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image207.png" 3671 v:shapes="Picture_x0020_97"><![endif]></span></p> 3624 3672 3625 3673 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Repeating the … … 3627 3675 3628 3676 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3629 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 11"3630 o:spid="_x0000_i1042" type="#_x0000_t75" style='width: 525pt;height:262.5pt;3631 visibility:visible;mso-wrap-style:square'> 3632 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 089.png"3633 o:title=""/> 3634 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=3503635 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 089.png"3636 v:shapes="Picture_x0020_ 11"><![endif]></span></p>3677 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_98" 3678 o:spid="_x0000_i1042" type="#_x0000_t75" style='width:468pt;height:153pt; 3679 visibility:visible;mso-wrap-style:square'> 3680 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image208.png" 3681 o:title=""/> 3682 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3683 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image209.png" 3684 v:shapes="Picture_x0020_98"><![endif]></span></p> 3637 3685 3638 3686 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Examination of … … 3641 3689 3642 3690 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3643 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 12"3644 o:spid="_x0000_i1041" type="#_x0000_t75" style='width: 525pt;height:450pt;3645 visibility:visible;mso-wrap-style:square'> 3646 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 090.png"3647 o:title=""/> 3648 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6003649 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 090.png"3650 v:shapes="Picture_x0020_ 12"><![endif]></span></p>3691 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_99" 3692 o:spid="_x0000_i1041" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3693 visibility:visible;mso-wrap-style:square'> 3694 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image210.png" 3695 o:title=""/> 3696 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3697 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image211.png" 3698 v:shapes="Picture_x0020_99"><![endif]></span></p> 3651 3699 3652 3700 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Showing that 3653 3701 perhaps the B19 phase needs high order spherical harmonics. Select the Data 3654 tab for the B19 phase and change the Harmonic order to 6. Then do Edit/Copy 3655 selected data for <span class=SpellE>Pref.Ori</span>. to the other data sets. 3656 This (after few repeats) gives a further improvement in the fit</p> 3657 3658 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3659 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_13" 3660 o:spid="_x0000_i1040" type="#_x0000_t75" style='width:525pt;height:262.5pt; 3661 visibility:visible;mso-wrap-style:square'> 3662 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image091.png" 3663 o:title=""/> 3664 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=350 3665 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image091.png" 3666 v:shapes="Picture_x0020_13"><![endif]></span></p> 3702 tab for the B19 phase and change the <b style='mso-bidi-font-weight:normal'><span 3703 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3704 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Harmonic 3705 order</span></b> to <b style='mso-bidi-font-weight:normal'><span 3706 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3707 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>6</span></b>. 3708 Then do <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3709 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3710 minor-latin'>Edit Phase/Copy selected data</span></b> for <span class=SpellE><b 3711 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3712 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3713 minor-latin'>Pref.Ori</span></b></span><b style='mso-bidi-font-weight:normal'><span 3714 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3715 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>.</span></b> 3716 to the other data sets. This (after few repeats) gives a further improvement in 3717 the fit</p> 3718 3719 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3720 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_100" 3721 o:spid="_x0000_i1040" type="#_x0000_t75" style='width:468pt;height:153pt; 3722 visibility:visible;mso-wrap-style:square'> 3723 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image212.png" 3724 o:title=""/> 3725 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3726 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image213.png" 3727 v:shapes="Picture_x0020_100"><![endif]></span></p> 3667 3728 3668 3729 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This fit is … … 3673 3734 0in;line-height:115%'>Step 2. Texture analysis</h3> 3674 3735 3675 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>During the sequential 3676 refinements done in Step 1, we fitted the profiles allowing strain parameters (<span 3677 class=SpellE>Dij</span>) for peak position shifts and <span class=SpellE>microstrain</span> 3678 for peak shape. We modeled the intensity variation with a spherical harmonics 3679 preferred orientation correction. If you select any PWDR entry from the GSAS-II 3680 data tree and pick the Reflection List subentry (at the bottom) you can see the 3681 magnitude of this correction for each reflection in each phase.</p> 3736 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>During the 3737 sequential refinements done in Step 1, we fitted the profiles allowing strain 3738 parameters (<span class=SpellE>Dij</span>) for peak position shifts and <span 3739 class=SpellE>microstrain</span> for peak shape. We modeled the intensity 3740 variation with a spherical harmonics preferred orientation correction. If you 3741 select any PWDR entry from the GSAS-II data tree and pick the Reflection List 3742 subentry (at the bottom) you can see the magnitude of this correction for each 3743 reflection in each phase.</p> 3682 3744 3683 3745 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>For the B2 … … 3685 3747 3686 3748 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3687 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_1 4"3688 o:spid="_x0000_i1039" type="#_x0000_t75" style='width: 659.25pt;height:262.5pt;3689 visibility:visible;mso-wrap-style:square'> 3690 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 092.png"3691 o:title=""/> 3692 </v:shape><![endif]--><![if !vml]><img border=0 width= 879 height=3503693 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 092.png"3694 v:shapes="Picture_x0020_1 4"><![endif]></span></p>3695 3696 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> and for the3697 B19 phase we see</p>3698 3699 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3700 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_1 5"3701 o:spid="_x0000_i1038" type="#_x0000_t75" style='width: 659.25pt;height:273pt;3702 visibility:visible;mso-wrap-style:square'> 3703 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 093.png"3704 o:title=""/> 3705 </v:shape><![endif]--><![if !vml]><img border=0 width= 879 height=3643706 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 093.png"3707 v:shapes="Picture_x0020_1 5"><![endif]></span></p>3749 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_101" 3750 o:spid="_x0000_i1039" type="#_x0000_t75" style='width:468pt;height:153pt; 3751 visibility:visible;mso-wrap-style:square'> 3752 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image214.png" 3753 o:title=""/> 3754 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3755 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image215.png" 3756 v:shapes="Picture_x0020_101"><![endif]></span></p> 3757 3758 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3759 class=GramE>and</span> for the B19 phase we see</p> 3760 3761 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3762 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_102" 3763 o:spid="_x0000_i1038" type="#_x0000_t75" style='width:468pt;height:153pt; 3764 visibility:visible;mso-wrap-style:square'> 3765 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image216.png" 3766 o:title=""/> 3767 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=204 3768 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image217.png" 3769 v:shapes="Picture_x0020_102"><![endif]></span></p> 3708 3770 3709 3771 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>The preferred … … 3725 3787 3726 3788 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Since this 3727 sample has wire texture, well use the default Texture model (cylindrical). 3728 Then set the Harmonic order to 12 (what we used earlier) and check the Refine 3729 and Show <span class=SpellE>coeff</span> boxes. The data window will be redrawn 3730 (and a blank plot will appear).</p> 3731 3732 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3733 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_17" 3734 o:spid="_x0000_i1036" type="#_x0000_t75" style='width:456pt;height:250.5pt; 3735 visibility:visible;mso-wrap-style:square'> 3736 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image066.png" 3737 o:title=""/> 3738 </v:shape><![endif]--><![if !vml]><img border=0 width=608 height=334 3739 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image066.png" 3740 v:shapes="Picture_x0020_17"><![endif]></span></p> 3741 3742 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Do 3743 Texture/Refine texture from the menu; the window will be repainted and a 3744 bullseye pole figure will appear. </p> 3745 3746 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3747 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_20" 3748 o:spid="_x0000_i1035" type="#_x0000_t75" style='width:480pt;height:267.75pt; 3749 visibility:visible;mso-wrap-style:square'> 3750 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image094.png" 3751 o:title=""/> 3752 </v:shape><![endif]--><![if !vml]><img border=0 width=640 height=357 3753 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image094.png" 3754 v:shapes="Picture_x0020_20"><![endif]></span></p> 3755 3756 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Change the 3757 Texture plot type to Inverse pole figure to get a more useful plot</p> 3758 3759 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3760 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_19" 3761 o:spid="_x0000_i1034" type="#_x0000_t75" style='width:525pt;height:450pt; 3762 visibility:visible;mso-wrap-style:square'> 3763 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image095.png" 3764 o:title=""/> 3765 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=600 3766 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image095.png" 3767 v:shapes="Picture_x0020_19"><![endif]></span></p> 3789 sample has wire texture, well use the default Texture model (<b 3790 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3791 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3792 minor-latin'>cylindrical</span></b>). Then set the <b style='mso-bidi-font-weight: 3793 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3794 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Harmonic 3795 order</span></b> to <b style='mso-bidi-font-weight:normal'><span 3796 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3797 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>12</span></b> 3798 (what we used earlier) and check the <b style='mso-bidi-font-weight:normal'><span 3799 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3800 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Refine</span></b> 3801 and <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3802 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3803 minor-latin'>Show <span class=SpellE>coeff</span></span></b> boxes. The data 3804 window will be redrawn (and an orange blank plot will appear).</p> 3805 3806 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3807 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_103" 3808 o:spid="_x0000_i1036" type="#_x0000_t75" style='width:468pt;height:168.75pt; 3809 visibility:visible;mso-wrap-style:square'> 3810 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image218.png" 3811 o:title=""/> 3812 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=225 3813 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image219.png" 3814 v:shapes="Picture_x0020_103"><![endif]></span></p> 3815 3816 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Do <b 3817 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3818 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3819 minor-latin'>Texture/Refine texture</span></b> from the menu; the window will 3820 be repainted and a bullseye pole figure will appear. </p> 3821 3822 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3823 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_104" 3824 o:spid="_x0000_i1035" type="#_x0000_t75" style='width:468pt;height:168.75pt; 3825 visibility:visible;mso-wrap-style:square'> 3826 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image220.png" 3827 o:title=""/> 3828 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=225 3829 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image221.png" 3830 v:shapes="Picture_x0020_104"><![endif]></span></p> 3831 3832 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Change the <b 3833 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3834 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3835 minor-latin'>Texture plot type</span></b> to <b style='mso-bidi-font-weight: 3836 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3837 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Inverse 3838 pole figure</span></b> to get a more useful plot</p> 3839 3840 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3841 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_105" 3842 o:spid="_x0000_i1034" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3843 visibility:visible;mso-wrap-style:square'> 3844 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image222.png" 3845 o:title=""/> 3846 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3847 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image223.png" 3848 v:shapes="Picture_x0020_105"><![endif]></span></p> 3768 3849 3769 3850 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>This is 3770 essentially the same as we obtained earlier in Method A (maybe not quite as3771 strong here).</p>3851 essentially the same as we obtained earlier in Method <span class=GramE>A</span> 3852 (maybe not quite as strong here).</p> 3772 3853 3773 3854 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Now select the 3774 Texture tab for the B19 phase and do the same; use Harmonic order 10 as we did 3775 earlier in Method A. After setting the two flags and doing Texture/Refine 3776 texture we get</p> 3777 3778 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3779 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_21" 3780 o:spid="_x0000_i1033" type="#_x0000_t75" style='width:502.5pt;height:375pt; 3781 visibility:visible;mso-wrap-style:square'> 3782 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image096.png" 3783 o:title=""/> 3784 </v:shape><![endif]--><![if !vml]><img border=0 width=670 height=500 3785 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image096.png" 3786 v:shapes="Picture_x0020_21"><![endif]></span></p> 3855 Texture tab for the B19 phase and do the same; use <b style='mso-bidi-font-weight: 3856 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3857 minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Harmonic 3858 order 10</span></b> as we did earlier in Method A. After setting the two flags 3859 and doing <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3860 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3861 minor-latin'>Texture/Refine texture</span></b> we get</p> 3862 3863 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3864 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_106" 3865 o:spid="_x0000_i1033" type="#_x0000_t75" style='width:468pt;height:243pt; 3866 visibility:visible;mso-wrap-style:square'> 3867 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image224.png" 3868 o:title=""/> 3869 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=324 3870 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image225.png" 3871 v:shapes="Picture_x0020_106"><![endif]></span></p> 3787 3872 3788 3873 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>And a bullseye … … 3790 3875 3791 3876 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 3792 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_22" 3793 o:spid="_x0000_i1032" type="#_x0000_t75" style='width:525pt;height:450pt; 3794 visibility:visible;mso-wrap-style:square'> 3795 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image097.png" 3796 o:title=""/> 3797 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=600 3798 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image097.png" 3799 v:shapes="Picture_x0020_22"><![endif]></span></p> 3800 3801 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Again this is very 3802 similar to what we found in Method A but again not quite as strong (max MRD ~13 3803 instead of ~18).</p> 3804 3805 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Now do a 3806 File/Save project from the main menu; this saves the final texture results done 3807 in Step 2 (you also will need it for Method C).</p> 3877 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_107" 3878 o:spid="_x0000_i1032" type="#_x0000_t75" style='width:468pt;height:401.25pt; 3879 visibility:visible;mso-wrap-style:square'> 3880 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image226.png" 3881 o:title=""/> 3882 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 3883 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image227.png" 3884 v:shapes="Picture_x0020_107"><![endif]></span></p> 3885 3886 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Again this is 3887 very similar to what we found in Method A but again not quite as strong (max 3888 MRD ~10 instead of ~18) and a bit choppier.</p> 3889 3890 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Now do a <b 3891 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3892 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 3893 minor-latin'>File/Save project</span></b> from the main menu; this saves the 3894 final texture results done in Step 2 (you also will need it for Method C).</p> 3808 3895 3809 3896 <h2 style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt;margin-left: … … 3842 3929 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Here we want 3843 3930 to clear refinement flags for all parameters that need not be varied in a 3844 texture analysis refinement. The general rule is to not refine any parameter unless3845 we expect it to affect the peak intensities. These are listed below:</p>3931 texture analysis refinement. The general rule is to not refine any parameter 3932 unless we expect it to affect the peak intensities. These are listed below:</p> 3846 3933 3847 3934 <p class=MsoListParagraphCxSpFirst style='margin-bottom:12.0pt;mso-add-space: … … 3877 3964 phase and its <b style='mso-bidi-font-weight:normal'><span style='font-family: 3878 3965 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 3879 minor-latin'>Data</span></b> <span class=GramE>tab.</span> Clearthe <span3966 minor-latin'>Data</span></b> tab. <span class=GramE>Clear</span> the <span 3880 3967 class=SpellE><b style='mso-bidi-font-weight:normal'><span style='font-family: 3881 3968 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: … … 3890 3977 avoid a lot of nasty (but harmless) messages at the start of the refinement). 3891 3978 Then do <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3892 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy3979 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3893 3980 flags</span></b> selecting all data to clear all the flags and an <b 3894 3981 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3895 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy selected3896 data</span></b> for <span class=SpellE><b style='mso-bidi-font-weight:normal'><span 3897 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3898 m so-hansi-theme-font:minor-latin'>Pref.Ori</span></b></span> to copy the zeroed3899 out harmonic coefficients.</p>3982 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3983 selected data</span></b> for <span class=SpellE><b style='mso-bidi-font-weight: 3984 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: 3985 minor-latin;mso-hansi-theme-font:minor-latin'>Pref.Ori</span></b></span> to 3986 copy the zeroed out harmonic coefficients.</p> 3900 3987 3901 3988 <p class=MsoListParagraphCxSpLast style='margin-bottom:12.0pt;mso-add-space: … … 3924 4011 avoid a lot of nasty (but harmless) messages at the start of the refinement). 3925 4012 Then do <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3926 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy4013 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3927 4014 flags</span></b> selecting all data to clear all the flags and an <b 3928 4015 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3929 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit /Copy4016 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Edit Phase/Copy 3930 4017 selected data</span></b> for <span class=SpellE><b style='mso-bidi-font-weight: 3931 4018 normal'><span style='font-family:"Calibri",sans-serif;mso-ascii-theme-font: … … 3950 4037 <p class=MsoNormal style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; 3951 4038 margin-left:.25in;line-height:115%'><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 3952 id="Picture_x0020_ 23" o:spid="_x0000_i1031" type="#_x0000_t75" style='width:480pt;3953 height: 267.75pt;visibility:visible;mso-wrap-style:square'>3954 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 098.png"3955 o:title=""/> 3956 </v:shape><![endif]--><![if !vml]><img border=0 width=6 40 height=3573957 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 098.png"3958 v:shapes="Picture_x0020_ 23"><![endif]></span></p>4039 id="Picture_x0020_108" o:spid="_x0000_i1031" type="#_x0000_t75" style='width:468pt; 4040 height:177pt;visibility:visible;mso-wrap-style:square'> 4041 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image228.png" 4042 o:title=""/> 4043 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=236 4044 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image229.png" 4045 v:shapes="Picture_x0020_108"><![endif]></span></p> 3959 4046 3960 4047 <p class=MsoNormal style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; … … 3973 4060 <p class=MsoNormal style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; 3974 4061 margin-left:.25in;line-height:115%'><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 3975 id="Picture_x0020_ 24" o:spid="_x0000_i1030" type="#_x0000_t75" style='width:480pt;3976 height: 267.75pt;visibility:visible;mso-wrap-style:square'>3977 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 099.png"3978 o:title=""/> 3979 </v:shape><![endif]--><![if !vml]><img border=0 width=6 40 height=3573980 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 099.png"3981 v:shapes="Picture_x0020_ 24"><![endif]></span></p>4062 id="Picture_x0020_109" o:spid="_x0000_i1030" type="#_x0000_t75" style='width:468pt; 4063 height:177pt;visibility:visible;mso-wrap-style:square'> 4064 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image230.png" 4065 o:title=""/> 4066 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=236 4067 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image231.png" 4068 v:shapes="Picture_x0020_109"><![endif]></span></p> 3982 4069 3983 4070 <p class=MsoNormal style='margin-top:0in;margin-right:0in;margin-bottom:12.0pt; … … 3990 4077 style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 3991 4078 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin'>Texture</span></b> 3992 <span class=GramE>tab.</span> Setthe <b style='mso-bidi-font-weight:normal'><span4079 tab. <span class=GramE>Set</span> the <b style='mso-bidi-font-weight:normal'><span 3993 4080 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 3994 4081 mso-hansi-theme-font:minor-latin'>Harmonic order</span></b> to zero and then … … 4010 4097 4011 4098 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4012 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_25" 4013 o:spid="_x0000_i1029" type="#_x0000_t75" style='width:363pt;height:120.75pt; 4014 visibility:visible;mso-wrap-style:square'> 4015 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image100.png" 4016 o:title=""/> 4017 </v:shape><![endif]--><![if !vml]><img border=0 width=484 height=161 4018 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image100.png" 4019 v:shapes="Picture_x0020_25"><![endif]></span></p> 4020 4021 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>In this case 4022 you do want to do a <span class=SpellE>nonsequential</span> full refinement, so 4023 press the OK button. A quick look at the console will show that there are 61 4024 variables in this refinement. If yours shows more then you didnt clear all the 4025 flags in Step 1. The <b style='mso-bidi-font-weight:normal'><span 4099 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_110" 4100 o:spid="_x0000_i1029" type="#_x0000_t75" style='width:421.5pt;height:97.5pt; 4101 visibility:visible;mso-wrap-style:square'> 4102 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image232.png" 4103 o:title=""/> 4104 </v:shape><![endif]--><![if !vml]><img border=0 width=562 height=130 4105 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image232.png" 4106 v:shapes="Picture_x0020_110"><![endif]></span></p> 4107 4108 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>In this case you 4109 do want to do a <span class=SpellE>nonsequential</span> full refinement, so 4110 press the <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 4111 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 4112 minor-latin'>OK</span></b> button. A quick look at the console will show that 4113 there are 61 variables in this refinement. If yours shows more then you didnt 4114 clear all the flags in Step 1. The <b style='mso-bidi-font-weight:normal'><span 4026 4115 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 4027 4116 mso-hansi-theme-font:minor-latin'>Sequential results</span></b> entry is … … 4038 4127 4039 4128 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4040 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 26"4041 o:spid="_x0000_i1028" type="#_x0000_t75" style='width: 525pt;height:450pt;4042 visibility:visible;mso-wrap-style:square'> 4043 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 101.png"4044 o:title=""/> 4045 </v:shape><![endif]--><![if !vml]><img border=0 width= 700 height=6004046 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 101.png"4047 v:shapes="Picture_x0020_ 26"><![endif]></span></p>4048 4049 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'> which is4050 almost identical to that from Method <span class=GramE>A.</span>The4129 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_111" 4130 o:spid="_x0000_i1028" type="#_x0000_t75" style='width:468pt;height:401.25pt; 4131 visibility:visible;mso-wrap-style:square'> 4132 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image233.png" 4133 o:title=""/> 4134 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 4135 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image234.png" 4136 v:shapes="Picture_x0020_111"><![endif]></span></p> 4137 4138 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4139 class=GramE>which</span> is almost identical to that from Method A. The 4051 4140 coefficients are seen in</p> 4052 4141 4053 4142 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4054 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_ 27"4055 o:spid="_x0000_i1027" type="#_x0000_t75" style='width:4 80pt;height:267.75pt;4056 visibility:visible;mso-wrap-style:square'> 4057 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 102.png"4058 o:title=""/> 4059 </v:shape><![endif]--><![if !vml]><img border=0 width=6 40 height=3574060 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image 102.png"4061 v:shapes="Picture_x0020_ 27"><![endif]></span></p>4143 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_112" 4144 o:spid="_x0000_i1027" type="#_x0000_t75" style='width:468pt;height:177pt; 4145 visibility:visible;mso-wrap-style:square'> 4146 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image235.png" 4147 o:title=""/> 4148 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=236 4149 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image236.png" 4150 v:shapes="Picture_x0020_112"><![endif]></span></p> 4062 4151 4063 4152 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>Now select the … … 4069 4158 4070 4159 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4071 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_28" 4072 o:spid="_x0000_i1026" type="#_x0000_t75" style='width:525pt;height:450pt; 4073 visibility:visible;mso-wrap-style:square'> 4074 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image103.png" 4075 o:title=""/> 4076 </v:shape><![endif]--><![if !vml]><img border=0 width=700 height=600 4077 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image103.png" 4078 v:shapes="Picture_x0020_28"><![endif]></span></p> 4079 4080 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>and also 4081 almost identical to what was obtained in Method A; the coefficients are seen in</p> 4082 4083 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4084 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_58" 4085 o:spid="_x0000_i1025" type="#_x0000_t75" style='width:502.5pt;height:375pt; 4086 visibility:visible;mso-wrap-style:square'> 4087 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image104.png" 4088 o:title=""/> 4089 </v:shape><![endif]--><![if !vml]><img border=0 width=670 height=500 4090 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image104.png" 4091 v:shapes="Picture_x0020_58"><![endif]></span></p> 4160 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_113" 4161 o:spid="_x0000_i1026" type="#_x0000_t75" style='width:468pt;height:401.25pt; 4162 visibility:visible;mso-wrap-style:square'> 4163 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image237.png" 4164 o:title=""/> 4165 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=535 4166 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image238.png" 4167 v:shapes="Picture_x0020_113"><![endif]></span></p> 4168 4169 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4170 class=GramE>and</span> also almost identical to what was obtained in Method A; 4171 the coefficients are seen in</p> 4172 4173 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'><span 4174 style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape id="Picture_x0020_114" 4175 o:spid="_x0000_i1025" type="#_x0000_t75" style='width:468pt;height:242.25pt; 4176 visibility:visible;mso-wrap-style:square'> 4177 <v:imagedata src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image239.png" 4178 o:title=""/> 4179 </v:shape><![endif]--><![if !vml]><img border=0 width=624 height=323 4180 src="Texture%20analysis%20of%202D%20data%20in%20GSAS-II_files/image240.png" 4181 v:shapes="Picture_x0020_114"><![endif]></span></p> 4092 4182 4093 4183 <p class=MsoNormal style='margin-bottom:12.0pt;line-height:115%'>With this -
Tutorials/2DTexture/Texture analysis of 2D data in GSAS-II_files/filelist.xml
r1856 r3055 4 4 <o:File HRef="colorschememapping.xml"/> 5 5 <o:File HRef="image001.png"/> 6 <o:File HRef="image0 02.png"/>6 <o:File HRef="image051.png"/> 7 7 <o:File HRef="image003.png"/> 8 <o:File HRef="image0 04.png"/>8 <o:File HRef="image052.png"/> 9 9 <o:File HRef="image005.png"/> 10 <o:File HRef="image0 06.png"/>10 <o:File HRef="image053.png"/> 11 11 <o:File HRef="image007.png"/> 12 <o:File HRef="image0 08.png"/>12 <o:File HRef="image054.png"/> 13 13 <o:File HRef="image009.png"/> 14 <o:File HRef="image0 10.png"/>14 <o:File HRef="image055.png"/> 15 15 <o:File HRef="image011.png"/> 16 <o:File HRef="image0 12.png"/>16 <o:File HRef="image056.png"/> 17 17 <o:File HRef="image013.png"/> 18 <o:File HRef="image0 14.png"/>18 <o:File HRef="image057.png"/> 19 19 <o:File HRef="image015.png"/> 20 <o:File HRef="image0 16.png"/>20 <o:File HRef="image058.png"/> 21 21 <o:File HRef="image017.png"/> 22 <o:File HRef="image0 18.png"/>22 <o:File HRef="image059.png"/> 23 23 <o:File HRef="image019.png"/> 24 <o:File HRef="image0 20.png"/>24 <o:File HRef="image060.png"/> 25 25 <o:File HRef="image021.png"/> 26 <o:File HRef="image0 22.png"/>26 <o:File HRef="image061.png"/> 27 27 <o:File HRef="image023.png"/> 28 <o:File HRef="image0 24.png"/>28 <o:File HRef="image062.png"/> 29 29 <o:File HRef="image025.png"/> 30 <o:File HRef="image0 26.png"/>30 <o:File HRef="image063.png"/> 31 31 <o:File HRef="image027.png"/> 32 <o:File HRef="image0 28.png"/>32 <o:File HRef="image064.png"/> 33 33 <o:File HRef="image029.png"/> 34 <o:File HRef="image0 30.png"/>34 <o:File HRef="image067.png"/> 35 35 <o:File HRef="image031.png"/> 36 <o:File HRef="image0 32.png"/>36 <o:File HRef="image068.png"/> 37 37 <o:File HRef="image033.png"/> 38 <o:File HRef="image0 34.png"/>38 <o:File HRef="image069.png"/> 39 39 <o:File HRef="image035.png"/> 40 <o:File HRef="image0 36.png"/>40 <o:File HRef="image070.png"/> 41 41 <o:File HRef="image037.png"/> 42 <o:File HRef="image0 38.png"/>42 <o:File HRef="image071.png"/> 43 43 <o:File HRef="image039.png"/> 44 <o:File HRef="image0 40.png"/>44 <o:File HRef="image072.png"/> 45 45 <o:File HRef="image041.png"/> 46 <o:File HRef="image0 42.png"/>46 <o:File HRef="image073.png"/> 47 47 <o:File HRef="image043.png"/> 48 <o:File HRef="image0 44.png"/>48 <o:File HRef="image074.png"/> 49 49 <o:File HRef="image045.png"/> 50 <o:File HRef="image0 46.png"/>50 <o:File HRef="image075.png"/> 51 51 <o:File HRef="image047.png"/> 52 <o:File HRef="image0 48.png"/>52 <o:File HRef="image076.png"/> 53 53 <o:File HRef="image049.png"/> 54 <o:File HRef="image050.png"/> 55 <o:File HRef="image051.png"/> 56 <o:File HRef="image052.png"/> 57 <o:File HRef="image053.png"/> 58 <o:File HRef="image054.png"/> 59 <o:File HRef="image055.png"/> 60 <o:File HRef="image056.png"/> 61 <o:File HRef="image057.png"/> 62 <o:File HRef="image058.png"/> 63 <o:File HRef="image059.png"/> 64 <o:File HRef="image060.png"/> 65 <o:File HRef="image061.png"/> 66 <o:File HRef="image062.png"/> 67 <o:File HRef="image063.png"/> 68 <o:File HRef="image064.png"/> 54 <o:File HRef="image077.png"/> 55 <o:File HRef="image105.png"/> 56 <o:File HRef="image078.png"/> 57 <o:File HRef="image107.png"/> 58 <o:File HRef="image163.png"/> 59 <o:File HRef="image109.png"/> 60 <o:File HRef="image164.png"/> 61 <o:File HRef="image111.png"/> 62 <o:File HRef="image165.png"/> 63 <o:File HRef="image113.png"/> 64 <o:File HRef="image166.png"/> 65 <o:File HRef="image115.png"/> 66 <o:File HRef="image167.png"/> 67 <o:File HRef="image117.png"/> 68 <o:File HRef="image168.png"/> 69 <o:File HRef="image119.png"/> 70 <o:File HRef="image169.png"/> 71 <o:File HRef="image121.png"/> 72 <o:File HRef="image170.png"/> 73 <o:File HRef="image123.png"/> 74 <o:File HRef="image171.png"/> 75 <o:File HRef="image125.png"/> 76 <o:File HRef="image172.png"/> 77 <o:File HRef="image127.png"/> 78 <o:File HRef="image173.png"/> 79 <o:File HRef="image129.png"/> 80 <o:File HRef="image174.png"/> 81 <o:File HRef="image131.png"/> 82 <o:File HRef="image175.png"/> 83 <o:File HRef="image133.png"/> 84 <o:File HRef="image176.png"/> 85 <o:File HRef="image135.png"/> 86 <o:File HRef="image177.png"/> 87 <o:File HRef="image137.png"/> 88 <o:File HRef="image178.png"/> 89 <o:File HRef="image139.png"/> 90 <o:File HRef="image179.png"/> 91 <o:File HRef="image141.png"/> 92 <o:File HRef="image180.png"/> 93 <o:File HRef="image143.png"/> 94 <o:File HRef="image181.png"/> 95 <o:File HRef="image145.png"/> 96 <o:File HRef="image182.png"/> 97 <o:File HRef="image147.png"/> 98 <o:File HRef="image183.png"/> 99 <o:File HRef="image149.png"/> 100 <o:File HRef="image184.png"/> 101 <o:File HRef="image151.png"/> 102 <o:File HRef="image185.png"/> 103 <o:File HRef="image153.png"/> 104 <o:File HRef="image186.png"/> 105 <o:File HRef="image155.png"/> 106 <o:File HRef="image187.png"/> 107 <o:File HRef="image157.png"/> 108 <o:File HRef="image188.png"/> 109 <o:File HRef="image159.png"/> 110 <o:File HRef="image189.png"/> 111 <o:File HRef="image161.png"/> 112 <o:File HRef="image190.png"/> 113 <o:File HRef="image191.png"/> 114 <o:File HRef="image192.png"/> 115 <o:File HRef="image193.png"/> 116 <o:File HRef="image194.png"/> 117 <o:File HRef="image195.png"/> 118 <o:File HRef="image196.png"/> 119 <o:File HRef="image197.png"/> 120 <o:File HRef="image198.png"/> 121 <o:File HRef="image083.png"/> 122 <o:File HRef="image199.png"/> 123 <o:File HRef="image200.png"/> 124 <o:File HRef="image201.png"/> 125 <o:File HRef="image202.png"/> 126 <o:File HRef="image203.png"/> 127 <o:File HRef="image204.png"/> 128 <o:File HRef="image205.png"/> 129 <o:File HRef="image206.png"/> 130 <o:File HRef="image207.png"/> 131 <o:File HRef="image208.png"/> 132 <o:File HRef="image209.png"/> 133 <o:File HRef="image210.png"/> 134 <o:File HRef="image211.png"/> 135 <o:File HRef="image212.png"/> 136 <o:File HRef="image213.png"/> 137 <o:File HRef="image214.png"/> 138 <o:File HRef="image215.png"/> 139 <o:File HRef="image216.png"/> 140 <o:File HRef="image217.png"/> 69 141 <o:File HRef="image065.png"/> 70 <o:File HRef="image066.png"/> 71 <o:File HRef="image067.png"/> 72 <o:File HRef="image068.png"/> 73 <o:File HRef="image069.png"/> 74 <o:File HRef="image070.png"/> 75 <o:File HRef="image071.png"/> 76 <o:File HRef="image072.png"/> 77 <o:File HRef="image073.png"/> 78 <o:File HRef="image074.png"/> 79 <o:File HRef="image075.png"/> 80 <o:File HRef="image076.png"/> 81 <o:File HRef="image077.png"/> 82 <o:File HRef="image078.png"/> 83 <o:File HRef="image079.png"/> 84 <o:File HRef="image080.png"/> 85 <o:File HRef="image081.png"/> 86 <o:File HRef="image082.png"/> 87 <o:File HRef="image083.png"/> 88 <o:File HRef="image084.png"/> 89 <o:File HRef="image085.png"/> 90 <o:File HRef="image086.png"/> 91 <o:File HRef="image087.png"/> 92 <o:File HRef="image088.png"/> 93 <o:File HRef="image089.png"/> 94 <o:File HRef="image090.png"/> 95 <o:File HRef="image091.png"/> 96 <o:File HRef="image092.png"/> 97 <o:File HRef="image093.png"/> 98 <o:File HRef="image094.png"/> 99 <o:File HRef="image095.png"/> 100 <o:File HRef="image096.png"/> 101 <o:File HRef="image097.png"/> 102 <o:File HRef="image098.png"/> 103 <o:File HRef="image099.png"/> 104 <o:File HRef="image100.png"/> 105 <o:File HRef="image101.png"/> 106 <o:File HRef="image102.png"/> 107 <o:File HRef="image103.png"/> 108 <o:File HRef="image104.png"/> 142 <o:File HRef="image218.png"/> 143 <o:File HRef="image219.png"/> 144 <o:File HRef="image220.png"/> 145 <o:File HRef="image221.png"/> 146 <o:File HRef="image222.png"/> 147 <o:File HRef="image223.png"/> 148 <o:File HRef="image224.png"/> 149 <o:File HRef="image225.png"/> 150 <o:File HRef="image226.png"/> 151 <o:File HRef="image227.png"/> 152 <o:File HRef="image228.png"/> 153 <o:File HRef="image229.png"/> 154 <o:File HRef="image230.png"/> 155 <o:File HRef="image231.png"/> 156 <o:File HRef="image232.png"/> 157 <o:File HRef="image233.png"/> 158 <o:File HRef="image234.png"/> 159 <o:File HRef="image235.png"/> 160 <o:File HRef="image236.png"/> 161 <o:File HRef="image237.png"/> 162 <o:File HRef="image238.png"/> 163 <o:File HRef="image239.png"/> 164 <o:File HRef="image240.png"/> 109 165 <o:File HRef="filelist.xml"/> 110 166 </xml>
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