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Tutorials/TOF Sequential Single Peak Fit/TOF Sequential Single Peak Fit.htm
r3476 r3547 25 25 <o:Author>Von Dreele</o:Author> 26 26 <o:LastAuthor>vondreele</o:LastAuthor> 27 <o:Revision>1 2</o:Revision>28 <o:TotalTime>5 52</o:TotalTime>27 <o:Revision>14</o:Revision> 28 <o:TotalTime>570</o:TotalTime> 29 29 <o:Created>2018-07-17T14:05:00Z</o:Created> 30 <o:LastSaved>2018-07- 17T21:55:00Z</o:LastSaved>30 <o:LastSaved>2018-07-25T14:52:00Z</o:LastSaved> 31 31 <o:Pages>1</o:Pages> 32 <o:Words>150 8</o:Words>33 <o:Characters>860 1</o:Characters>32 <o:Words>1509</o:Words> 33 <o:Characters>8602</o:Characters> 34 34 <o:Lines>71</o:Lines> 35 35 <o:Paragraphs>20</o:Paragraphs> 36 <o:CharactersWithSpaces>100 89</o:CharactersWithSpaces>36 <o:CharactersWithSpaces>10091</o:CharactersWithSpaces> 37 37 <o:Version>16.00</o:Version> 38 38 </o:DocumentProperties> … … 662 662 /* Font Definitions */ 663 663 @font-face 664 {font-family:Wingdings;665 panose-1:5 0 0 0 0 0 0 0 0 0;666 mso-font-charset:2;667 mso-generic-font-family:auto;668 mso-font-pitch:variable;669 mso-font-signature:0 268435456 0 0 -2147483648 0;}670 @font-face671 664 {font-family:"Cambria Math"; 672 665 panose-1:2 4 5 3 5 4 6 3 2 4; 673 mso-font-charset: 0;666 mso-font-charset:1; 674 667 mso-generic-font-family:roman; 675 668 mso-font-pitch:variable; 676 mso-font-signature: -536869121 1107305727 33554432 0 4150;}669 mso-font-signature:0 0 0 0 0 0;} 677 670 @font-face 678 671 {font-family:Calibri; … … 681 674 mso-generic-font-family:swiss; 682 675 mso-font-pitch:variable; 683 mso-font-signature:-536859905 1073786111 10 511 0;}676 mso-font-signature:-536859905 -1073732485 9 0 511 0;} 684 677 @font-face 685 678 {font-family:Tahoma; … … 718 711 font-weight:bold;} 719 712 h2 720 {mso-style-priority:9; 713 {mso-style-noshow:yes; 714 mso-style-priority:9; 721 715 mso-style-qformat:yes; 722 716 mso-style-link:"Heading 2 Char"; … … 964 958 span.Heading2Char 965 959 {mso-style-name:"Heading 2 Char"; 960 mso-style-noshow:yes; 966 961 mso-style-priority:9; 967 962 mso-style-unhide:no; … … 1156 1151 div.WordSection1 1157 1152 {page:WordSection1;} 1158 /* List Definitions */1159 @list l01160 {mso-list-id:1325084593;1161 mso-list-type:hybrid;1162 mso-list-template-ids:-1895027428 67698689 67698691 67698693 67698689 67698691 67698693 67698689 67698691 67698693;}1163 @list l0:level11164 {mso-level-number-format:bullet;1165 mso-level-text:\F0B7;1166 mso-level-tab-stop:none;1167 mso-level-number-position:left;1168 text-indent:-.25in;1169 font-family:Symbol;}1170 @list l0:level21171 {mso-level-number-format:bullet;1172 mso-level-text:o;1173 mso-level-tab-stop:none;1174 mso-level-number-position:left;1175 text-indent:-.25in;1176 font-family:"Courier New";}1177 @list l0:level31178 {mso-level-number-format:bullet;1179 mso-level-text:\F0A7;1180 mso-level-tab-stop:none;1181 mso-level-number-position:left;1182 text-indent:-.25in;1183 font-family:Wingdings;}1184 @list l0:level41185 {mso-level-number-format:bullet;1186 mso-level-text:\F0B7;1187 mso-level-tab-stop:none;1188 mso-level-number-position:left;1189 text-indent:-.25in;1190 font-family:Symbol;}1191 @list l0:level51192 {mso-level-number-format:bullet;1193 mso-level-text:o;1194 mso-level-tab-stop:none;1195 mso-level-number-position:left;1196 text-indent:-.25in;1197 font-family:"Courier New";}1198 @list l0:level61199 {mso-level-number-format:bullet;1200 mso-level-text:\F0A7;1201 mso-level-tab-stop:none;1202 mso-level-number-position:left;1203 text-indent:-.25in;1204 font-family:Wingdings;}1205 @list l0:level71206 {mso-level-number-format:bullet;1207 mso-level-text:\F0B7;1208 mso-level-tab-stop:none;1209 mso-level-number-position:left;1210 text-indent:-.25in;1211 font-family:Symbol;}1212 @list l0:level81213 {mso-level-number-format:bullet;1214 mso-level-text:o;1215 mso-level-tab-stop:none;1216 mso-level-number-position:left;1217 text-indent:-.25in;1218 font-family:"Courier New";}1219 @list l0:level91220 {mso-level-number-format:bullet;1221 mso-level-text:\F0A7;1222 mso-level-tab-stop:none;1223 mso-level-number-position:left;1224 text-indent:-.25in;1225 font-family:Wingdings;}1226 ol1227 {margin-bottom:0in;}1228 ul1229 {margin-bottom:0in;}1230 1153 --> 1231 1154 </style> … … 1272 1195 1273 1196 <p class=MsoNormal>A common analysis of diffraction data obtained from a 1274 polycrystalline sample subjected to a changing uniaxial load is to follow the 1275 behavior of fitted single peaks. 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TextBox_x0020_13 Isosceles_x0020_Triangle_x0020_11 Isosceles_x0020_Triangle_x0020_12 Rectangle_x0020_13"><![endif]><!--[if gte vml 1]><v:shapetype 1698 1627 id="_x0000_t75" coordsize="21600,21600" o:spt="75" o:preferrelative="t" 1699 1628 path="m@4@5l@4@11@9@11@9@5xe" filled="f" stroked="f"> … … 1720 1649 </v:shape><span style='mso-element:field-end'></span><![endif]--></p> 1721 1650 1722 <p class=MsoNormal><span class=GramE>has</span> panels of detectors on both sides 1723 of the sample (in this case a Œ stainless steel rod) oriented so that the 1724 loading axis is 45° to the incident neutron beam. Thus one detector Bank 1 only 1725 views crystallites with diffraction vectors parallel to the loading direction 1726 while the other Bank 2 only views crystallites with diffraction vectors perpendicular 1727 to the load. In such an experiment, as the load is increased (as a tension) we 1728 would expect that the reflections would shift to higher d-<span class=SpellE>spacings</span> 1729 in Bank 1 and those seen in Bank 2 would shift to smaller d-<span class=SpellE>spacings</span>. 1730 If the load is a compression, then the responses in the reflection positions 1731 would be reversed. The shift records the response strain of the crystal lattice 1732 to the load stress. The particular experiment done here was to subject the 1733 steel rod to ten tension/compression cycles over 13 hours recording a 1734 diffraction pattern from the two detectors each minute yielding ~800 data sets. 1735 The 1<sup>st</sup> loading cycle was done slowly over ~4.5hrs and the remaining 1736 ones done ~1hr each; we will focus on just the 1<sup>st</sup> cycle for this 1737 tutorial comprising 61 powder patterns. Note that menu entries and user input 1738 are shown in bold face below as <b style='mso-bidi-font-weight:normal'><span 1651 <p class=MsoNormal><span class=GramE>has</span> panels of detectors on both 1652 sides of the sample (in this case a Œ stainless steel rod) oriented so that 1653 the loading axis is 45° to the incident neutron beam. Thus one detector Bank 1654 1 only views crystallites with diffraction vectors parallel to the loading 1655 direction while the other Bank 2 only views crystallites with diffraction 1656 vectors perpendicular to the load. In such an experiment, as the load is 1657 increased (as a tension) we would expect that the reflections would shift to 1658 higher d-<span class=SpellE>spacings</span> in Bank 1 and those seen in Bank 2 1659 would shift to smaller d-<span class=SpellE>spacings</span>. If the load is a 1660 compression, then the responses in the reflection positions would be reversed. 1661 The shift records the response strain of the crystal lattice to the load 1662 stress. The particular experiment done here was to subject the steel rod to 1663 ten tension/compression cycles over 13 hours recording a diffraction pattern 1664 from the two detectors each minute yielding ~800 data sets. The 1<sup>st</sup> 1665 loading cycle was done slowly over ~4.5hrs and the remaining ones done ~1hr 1666 each; we will focus on just the 1<sup>st</sup> cycle for this tutorial 1667 comprising 61 powder patterns. Note that menu entries and user input are shown 1668 in bold face below as <b style='mso-bidi-font-weight:normal'><span 1739 1669 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 1740 1670 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>Help/About … … 1745 1675 (here <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 1746 1676 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 1747 minor-latin'>About GSAS-II</span></b>).< o:p></o:p></p>1677 minor-latin'>About GSAS-II</span></b>).</p> 1748 1678 1749 1679 <p class=MsoNormal>If you have not done so already, <u><span style='color:#0070C0'><a … … 1755 1685 <p class=MsoNormal>Use the <b style='mso-bidi-font-weight:normal'>Import/Powder 1756 1686 data/from GSAS powder data file</b> menu item to read the data file into the 1757 current GSAS-II project. < o:p></o:p></p>1758 1759 <p class=MsoNormal><span style='mso-spacerun:yes'> </span>< o:p></o:p></p>1687 current GSAS-II project. </p> 1688 1689 <p class=MsoNormal><span style='mso-spacerun:yes'> </span></p> 1760 1690 1761 1691 <p class=MsoNormal>A file selection dialog will be shown; its appearance will … … 1772 1702 id="Picture_x0020_14" o:spid="_x0000_i1059" type="#_x0000_t75" style='width:176.25pt; 1773 1703 height:227.25pt;visibility:visible;mso-wrap-style:square'> 1774 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image00 3.png"1704 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image002.png" 1775 1705 o:title=""/> 1776 1706 </v:shape><![endif]--><![if !vml]><img border=0 width=235 height=303 1777 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 29.gif" v:shapes="Picture_x0020_14"><![endif]></span></p>1707 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image003.gif" v:shapes="Picture_x0020_14"><![endif]></span></p> 1778 1708 1779 1709 <p class=MsoNormal>Select just <b style='mso-bidi-font-weight:normal'><span … … 1789 1719 id="Picture_x0020_15" o:spid="_x0000_i1058" type="#_x0000_t75" style='width:466.5pt; 1790 1720 height:174pt;visibility:visible;mso-wrap-style:square'> 1791 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image00 5.png"1721 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image004.png" 1792 1722 o:title=""/> 1793 1723 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=232 1794 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 30.gif" v:shapes="Picture_x0020_15"><![endif]></span></p>1724 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image005.gif" v:shapes="Picture_x0020_15"><![endif]></span></p> 1795 1725 1796 1726 <p class=MsoNormal><span class=GramE>and</span> show the powder pattern</p> … … 1799 1729 id="Picture_x0020_16" o:spid="_x0000_i1057" type="#_x0000_t75" style='width:466.5pt; 1800 1730 height:331.5pt;visibility:visible;mso-wrap-style:square'> 1801 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image00 7.png"1731 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image006.png" 1802 1732 o:title=""/> 1803 1733 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 1804 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 31.gif" v:shapes="Picture_x0020_16"><![endif]></span></p>1734 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image007.gif" v:shapes="Picture_x0020_16"><![endif]></span></p> 1805 1735 1806 1736 <p class=MsoNormal>You may start here but it is slightly better to start with … … 1818 1748 id="Picture_x0020_17" o:spid="_x0000_i1056" type="#_x0000_t75" style='width:467.25pt; 1819 1749 height:254.25pt;visibility:visible;mso-wrap-style:square'> 1820 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image00 9.png"1750 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image008.png" 1821 1751 o:title=""/> 1822 1752 </v:shape><![endif]--><![if !vml]><img border=0 width=623 height=339 1823 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 32.gif" v:shapes="Picture_x0020_17"><![endif]></span></p>1753 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image009.gif" v:shapes="Picture_x0020_17"><![endif]></span></p> 1824 1754 1825 1755 <p class=MsoNormal>The plot shows the current limits as vertical green & … … 1829 1759 id="Picture_x0020_18" o:spid="_x0000_i1055" type="#_x0000_t75" style='width:467.25pt; 1830 1760 height:333pt;visibility:visible;mso-wrap-style:square'> 1831 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image01 1.png"1761 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image010.png" 1832 1762 o:title=""/> 1833 1763 </v:shape><![endif]--><![if !vml]><img border=0 width=623 height=444 1834 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 33.gif" v:shapes="Picture_x0020_18"><![endif]></span><o:p></o:p></p>1764 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image011.gif" v:shapes="Picture_x0020_18"><![endif]></span></p> 1835 1765 1836 1766 <p class=MsoNormal>Set the <span class=SpellE><b style='mso-bidi-font-weight: … … 1850 1780 id="Picture_x0020_19" o:spid="_x0000_i1054" type="#_x0000_t75" style='width:467.25pt; 1851 1781 height:254.25pt;visibility:visible;mso-wrap-style:square'> 1852 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image01 3.png"1782 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image012.png" 1853 1783 o:title=""/> 1854 1784 </v:shape><![endif]--><![if !vml]><img border=0 width=623 height=339 1855 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 34.gif" v:shapes="Picture_x0020_19"><![endif]></span></p>1785 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image013.gif" v:shapes="Picture_x0020_19"><![endif]></span></p> 1856 1786 1857 1787 <p class=MsoNormal><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 1858 1788 id="Picture_x0020_20" o:spid="_x0000_i1053" type="#_x0000_t75" style='width:466.5pt; 1859 1789 height:331.5pt;visibility:visible;mso-wrap-style:square'> 1860 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image01 5.png"1790 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image014.png" 1861 1791 o:title=""/> 1862 1792 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 1863 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 35.gif" v:shapes="Picture_x0020_20"><![endif]></span></p>1793 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image015.gif" v:shapes="Picture_x0020_20"><![endif]></span></p> 1864 1794 1865 1795 <p class=MsoNormal>Next copy these limits to the other PWDR data sets; do <b … … 1871 1801 id="Picture_x0020_21" o:spid="_x0000_i1052" type="#_x0000_t75" style='width:189.75pt; 1872 1802 height:316.5pt;visibility:visible;mso-wrap-style:square'> 1873 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image01 7.png"1803 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image016.png" 1874 1804 o:title=""/> 1875 1805 </v:shape><![endif]--><![if !vml]><img border=0 width=253 height=422 1876 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 36.gif" v:shapes="Picture_x0020_21"><![endif]></span></p>1806 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image017.gif" v:shapes="Picture_x0020_21"><![endif]></span></p> 1877 1807 1878 1808 <p class=MsoNormal>Do <b style='mso-bidi-font-weight:normal'><span … … 1898 1828 id="Picture_x0020_23" o:spid="_x0000_i1051" type="#_x0000_t75" style='width:466.5pt; 1899 1829 height:254.25pt;visibility:visible;mso-wrap-style:square'> 1900 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image01 9.png"1830 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image018.png" 1901 1831 o:title=""/> 1902 1832 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=339 1903 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 37.gif" v:shapes="Picture_x0020_23"><![endif]></span></p>1833 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image019.gif" v:shapes="Picture_x0020_23"><![endif]></span></p> 1904 1834 1905 1835 <p class=MsoNormal><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 1906 1836 id="Picture_x0020_24" o:spid="_x0000_i1050" type="#_x0000_t75" style='width:466.5pt; 1907 1837 height:331.5pt;visibility:visible;mso-wrap-style:square'> 1908 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image02 1.png"1838 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image020.png" 1909 1839 o:title=""/> 1910 1840 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 1911 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 38.gif" v:shapes="Picture_x0020_24"><![endif]></span></p>1841 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image021.gif" v:shapes="Picture_x0020_24"><![endif]></span></p> 1912 1842 1913 1843 <p class=MsoNormal>Next do <b style='mso-bidi-font-weight:normal'><span … … 1926 1856 id="Picture_x0020_25" o:spid="_x0000_i1049" type="#_x0000_t75" style='width:466.5pt; 1927 1857 height:331.5pt;visibility:visible;mso-wrap-style:square'> 1928 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image02 3.png"1858 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image022.png" 1929 1859 o:title=""/> 1930 1860 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 1931 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 39.gif" v:shapes="Picture_x0020_25"><![endif]></span></p>1861 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image023.gif" v:shapes="Picture_x0020_25"><![endif]></span></p> 1932 1862 1933 1863 <p class=MsoNormal><span class=GramE>and</span> shows the need for further … … 1948 1878 id="Picture_x0020_26" o:spid="_x0000_i1048" type="#_x0000_t75" style='width:466.5pt; 1949 1879 height:168pt;visibility:visible;mso-wrap-style:square'> 1950 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image02 5.png"1880 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image024.png" 1951 1881 o:title=""/> 1952 1882 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=224 1953 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 40.gif" v:shapes="Picture_x0020_26"><![endif]></span></p>1883 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image025.gif" v:shapes="Picture_x0020_26"><![endif]></span></p> 1954 1884 1955 1885 <p class=MsoNormal><span class=GramE>with</span> check marks in three columns. … … 1962 1892 id="Picture_x0020_28" o:spid="_x0000_i1047" type="#_x0000_t75" style='width:466.5pt; 1963 1893 height:331.5pt;visibility:visible;mso-wrap-style:square'> 1964 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image02 7.png"1894 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image026.png" 1965 1895 o:title=""/> 1966 1896 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 1967 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 41.gif" v:shapes="Picture_x0020_28"><![endif]></span></p>1897 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image027.gif" v:shapes="Picture_x0020_28"><![endif]></span></p> 1968 1898 1969 1899 <p class=MsoNormal>Ive pressed both <b style='mso-bidi-font-weight:normal'><span … … 1999 1929 id="Picture_x0020_29" o:spid="_x0000_i1046" type="#_x0000_t75" style='width:189.75pt; 2000 1930 height:339pt;visibility:visible;mso-wrap-style:square'> 2001 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 42.png"1931 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image028.png" 2002 1932 o:title=""/> 2003 1933 </v:shape><![endif]--><![if !vml]><img border=0 width=253 height=452 2004 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 43.gif" v:shapes="Picture_x0020_29"><![endif]></span></p>1934 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image029.gif" v:shapes="Picture_x0020_29"><![endif]></span></p> 2005 1935 2006 1936 <p class=MsoNormal>Notice this one does offer the possibility of doing the fit … … 2019 1949 id="Picture_x0020_30" o:spid="_x0000_i1045" type="#_x0000_t75" style='width:472.5pt; 2020 1950 height:166.5pt;visibility:visible;mso-wrap-style:square'> 2021 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 44.png"1951 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image030.png" 2022 1952 o:title=""/> 2023 1953 </v:shape><![endif]--><![if !vml]><img border=0 width=630 height=222 2024 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 45.gif" v:shapes="Picture_x0020_30"><![endif]></span></p>1954 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image031.gif" v:shapes="Picture_x0020_30"><![endif]></span></p> 2025 1955 2026 1956 <p class=MsoNormal>The table is quite large with >30 columns and 61 rows so 2027 Ive shown only a bit of it. If you select a row, the plot will show the corresponding2028 PWDR plot and fit; this is the same as selecting a PWDR entry in the main data 2029 t ree (this will respond to arrow keys to step from one PWDR entry to the next2030 and show the corresponding plot). For your first view of the sequential result 2031 double click on the <b style='mso-bidi-font-weight:normal'><span1957 Ive shown only a bit of it. If you select a row, the plot will show the 1958 corresponding PWDR plot and fit; this is the same as selecting a PWDR entry in 1959 the main data tree (this will respond to arrow keys to step from one PWDR entry 1960 to the next and show the corresponding plot). For your first view of the sequential 1961 result double click on the <b style='mso-bidi-font-weight:normal'><span 2032 1962 style='font-family:"Calibri",sans-serif;mso-ascii-theme-font:minor-latin; 2033 1963 mso-hansi-theme-font:minor-latin;mso-bidi-theme-font:minor-latin'>pos0</span></b> … … 2038 1968 id="Picture_x0020_31" o:spid="_x0000_i1044" type="#_x0000_t75" style='width:471.75pt; 2039 1969 height:336pt;visibility:visible;mso-wrap-style:square'> 2040 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 46.png"1970 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image032.png" 2041 1971 o:title=""/> 2042 1972 </v:shape><![endif]--><![if !vml]><img border=0 width=629 height=448 2043 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 47.gif" v:shapes="Picture_x0020_31"><![endif]></span></p>1973 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image033.gif" v:shapes="Picture_x0020_31"><![endif]></span></p> 2044 1974 2045 1975 <p class=MsoNormal>This shows the result of a loading/unloading cycle … … 2060 1990 id="Picture_x0020_33" o:spid="_x0000_i1043" type="#_x0000_t75" style='width:445.5pt; 2061 1991 height:395.25pt;visibility:visible;mso-wrap-style:square'> 2062 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 51.png"1992 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image034.png" 2063 1993 o:title=""/> 2064 1994 </v:shape><![endif]--><![if !vml]><img border=0 width=594 height=527 2065 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 66.gif" v:shapes="Picture_x0020_33"><![endif]></span></p>1995 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image035.gif" v:shapes="Picture_x0020_33"><![endif]></span></p> 2066 1996 2067 1997 <p class=MsoNormal>Notice there is an entry at the bottom of the table for <b … … 2082 2012 id="Picture_x0020_34" o:spid="_x0000_i1042" type="#_x0000_t75" style='width:469.5pt; 2083 2013 height:321.75pt;visibility:visible;mso-wrap-style:square'> 2084 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 53.png"2014 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image036.png" 2085 2015 o:title=""/> 2086 2016 </v:shape><![endif]--><![if !vml]><img border=0 width=626 height=429 2087 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 67.gif" v:shapes="Picture_x0020_34"><![endif]></span><o:p></o:p></p>2017 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image037.gif" v:shapes="Picture_x0020_34"><![endif]></span></p> 2088 2018 2089 2019 <p class=MsoNormal>Looking over the column headings, one is marked stress and 2090 2020 another is marked force. Their ratio is presumably the cross-section area of 2091 the steel rod (in mm<sup>2</sup>). So (counting from zero) the column we want 2092 for<b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif;2021 the steel rod (in mm<sup>2</sup>). So (counting from zero) the column we want for 2022 <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2093 2023 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 2094 2024 minor-latin'>Applied loa</span></b>d is Column #6 (1<sup>st</sup> value … … 2101 2031 id="Picture_x0020_35" o:spid="_x0000_i1041" type="#_x0000_t75" style='width:427.5pt; 2102 2032 height:293.25pt;visibility:visible;mso-wrap-style:square'> 2103 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 55.png"2033 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image038.png" 2104 2034 o:title=""/> 2105 2035 </v:shape><![endif]--><![if !vml]><img border=0 width=570 height=391 2106 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 68.gif" v:shapes="Picture_x0020_35"><![endif]></span></p>2036 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image039.gif" v:shapes="Picture_x0020_35"><![endif]></span></p> 2107 2037 2108 2038 <p class=MsoNormal>Notice you can apply conversion factors to the column of … … 2126 2056 id="Picture_x0020_36" o:spid="_x0000_i1040" type="#_x0000_t75" style='width:426.75pt; 2127 2057 height:198.75pt;visibility:visible;mso-wrap-style:square'> 2128 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 57.png"2058 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image040.png" 2129 2059 o:title=""/> 2130 2060 </v:shape><![endif]--><![if !vml]><img border=0 width=569 height=265 2131 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 69.gif" v:shapes="Picture_x0020_36"><![endif]></span></p>2061 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image041.gif" v:shapes="Picture_x0020_36"><![endif]></span></p> 2132 2062 2133 2063 <p class=MsoNormal>Applied load is a new column entry in the table; double … … 2139 2069 id="Picture_x0020_37" o:spid="_x0000_i1039" type="#_x0000_t75" style='width:471pt; 2140 2070 height:335.25pt;visibility:visible;mso-wrap-style:square'> 2141 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 46.png"2071 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image032.png" 2142 2072 o:title=""/> 2143 2073 </v:shape><![endif]--><![if !vml]><img border=0 width=628 height=447 2144 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image070.gif" v:shapes="Picture_x0020_37"><![endif]></span></p> 2145 2146 <p class=MsoNormal><span class=GramE>which</span> is unchanged from before. 2147 Place the cursor anywhere on the plot (i.e. select it) and press <span 2148 class=GramE>the <b style='mso-bidi-font-weight:normal'><span style='font-family: 2149 "Calibri",sans-serif;mso-ascii-theme-font:minor-latin;mso-hansi-theme-font: 2150 minor-latin;mso-bidi-theme-font:minor-latin'>s</span></b></span> key; a popup 2151 dialog will appear.</p> 2074 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image042.gif" v:shapes="Picture_x0020_37"><![endif]></span></p> 2075 2076 <p class=MsoNormal><span class=GramE>which</span> is unchanged from before. Place 2077 the cursor anywhere on the plot (i.e. select it) and press <span class=GramE>the 2078 <b style='mso-bidi-font-weight:normal'><span style='font-family:"Calibri",sans-serif; 2079 mso-ascii-theme-font:minor-latin;mso-hansi-theme-font:minor-latin;mso-bidi-theme-font: 2080 minor-latin'>s</span></b></span> key; a popup dialog will appear.</p> 2152 2081 2153 2082 <p class=MsoNormal><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 2154 2083 id="Picture_x0020_39" o:spid="_x0000_i1038" type="#_x0000_t75" style='width:240pt; 2155 2084 height:232.5pt;visibility:visible;mso-wrap-style:square'> 2156 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 60.png"2085 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image043.png" 2157 2086 o:title=""/> 2158 2087 </v:shape><![endif]--><![if !vml]><img border=0 width=320 height=310 2159 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 71.gif" v:shapes="Picture_x0020_39"><![endif]></span></p>2088 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image044.gif" v:shapes="Picture_x0020_39"><![endif]></span></p> 2160 2089 2161 2090 <p class=MsoNormal>Select <span class=GramE><b style='mso-bidi-font-weight: … … 2175 2104 id="Picture_x0020_40" o:spid="_x0000_i1037" type="#_x0000_t75" style='width:466.5pt; 2176 2105 height:331.5pt;visibility:visible;mso-wrap-style:square'> 2177 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 62.png"2106 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image045.png" 2178 2107 o:title=""/> 2179 2108 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 2180 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image072.gif" v:shapes="Picture_x0020_40"><![endif]></span></p> 2109 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image046.gif" v:shapes="Picture_x0020_40"><![endif]><!--[if gte vml 1]><v:shape 2110 id="Picture_x0020_41" o:spid="_x0000_i1036" type="#_x0000_t75" style='width:464.25pt; 2111 height:330pt;visibility:visible;mso-wrap-style:square'> 2112 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image047.png" 2113 o:title=""/> 2114 </v:shape><![endif]--><![if !vml]><img border=0 width=619 height=440 2115 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image048.gif" v:shapes="Picture_x0020_41"><![endif]></span></p> 2181 2116 2182 2117 <p class=MsoNormal>This shows the perfectly linear response of peak position … … 2186 2121 parameter; the plot will change</p> 2187 2122 2188 <p class=MsoNormal><span style='mso-no-proof:yes'><!--[if gte vml 1]><v:shape 2189 id="Picture_x0020_41" o:spid="_x0000_i1036" type="#_x0000_t75" style='width:464.25pt; 2190 height:330pt;visibility:visible;mso-wrap-style:square'> 2191 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image064.png" 2192 o:title=""/> 2193 </v:shape><![endif]--><![if !vml]><img border=0 width=619 height=440 2194 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image073.gif" v:shapes="Picture_x0020_41"><![endif]></span></p> 2123 <p class=MsoNormal><o:p> </o:p></p> 2195 2124 2196 2125 <p class=MsoNormal>Pos1 shows hysteresis in a load/unload cycle; some of other … … 2216 2145 o:spid="_x0000_i1035" type="#_x0000_t75" style='width:466.5pt;height:331.5pt; 2217 2146 visibility:visible;mso-wrap-style:square'> 2218 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 62.png"2147 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image045.png" 2219 2148 o:title=""/> 2220 2149 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 2221 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 95.gif" v:shapes="Picture_x0020_42"><![endif]></span></p>2150 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image049.gif" v:shapes="Picture_x0020_42"><![endif]></span></p> 2222 2151 2223 2152 <p class=MsoNormal>Using the cursor, find the zero load point on the curve and … … 2233 2162 id="Picture_x0020_46" o:spid="_x0000_i1034" type="#_x0000_t75" style='width:465pt; 2234 2163 height:255pt;visibility:visible;mso-wrap-style:square'> 2235 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 75.png"2164 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image050.png" 2236 2165 o:title=""/> 2237 2166 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2238 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 96.gif" v:shapes="Picture_x0020_46"><![endif]></span></p>2167 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image051.gif" v:shapes="Picture_x0020_46"><![endif]></span></p> 2239 2168 2240 2169 <p class=MsoNormal>Enter <b style='mso-bidi-font-weight:normal'><span … … 2246 2175 id="Picture_x0020_47" o:spid="_x0000_i1033" type="#_x0000_t75" style='width:465pt; 2247 2176 height:255pt;visibility:visible;mso-wrap-style:square'> 2248 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 77.png"2177 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image052.png" 2249 2178 o:title=""/> 2250 2179 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2251 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 97.gif" v:shapes="Picture_x0020_47"><![endif]></span></p>2180 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image053.gif" v:shapes="Picture_x0020_47"><![endif]></span></p> 2252 2181 2253 2182 <p class=MsoNormal>Select <b style='mso-bidi-font-weight:normal'><span … … 2267 2196 id="Picture_x0020_48" o:spid="_x0000_i1032" type="#_x0000_t75" style='width:465pt; 2268 2197 height:255pt;visibility:visible;mso-wrap-style:square'> 2269 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 79.png"2198 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image054.png" 2270 2199 o:title=""/> 2271 2200 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2272 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 98.gif" v:shapes="Picture_x0020_48"><![endif]></span></p>2201 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image055.gif" v:shapes="Picture_x0020_48"><![endif]></span></p> 2273 2202 2274 2203 <p class=MsoNormal>All looks properly filled in so press <b style='mso-bidi-font-weight: … … 2281 2210 id="Picture_x0020_49" o:spid="_x0000_i1031" type="#_x0000_t75" style='width:466.5pt; 2282 2211 height:192.75pt;visibility:visible;mso-wrap-style:square'> 2283 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 81.png"2212 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image056.png" 2284 2213 o:title=""/> 2285 2214 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=257 2286 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 99.gif" v:shapes="Picture_x0020_49"><![endif]></span></p>2215 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image057.gif" v:shapes="Picture_x0020_49"><![endif]></span></p> 2287 2216 2288 2217 <p class=MsoNormal>Click on that column heading to see its plot vs load</p> … … 2291 2220 id="Picture_x0020_50" o:spid="_x0000_i1030" type="#_x0000_t75" style='width:466.5pt; 2292 2221 height:331.5pt;visibility:visible;mso-wrap-style:square'> 2293 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 83.png"2222 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image058.png" 2294 2223 o:title=""/> 2295 2224 </v:shape><![endif]--><![if !vml]><img border=0 width=622 height=442 2296 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 100.gif" v:shapes="Picture_x0020_50"><![endif]></span></p>2225 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image059.gif" v:shapes="Picture_x0020_50"><![endif]></span></p> 2297 2226 2298 2227 <p class=MsoNormal>This is what we want to fit to get the <span class=SpellE>Hookes</span> … … 2305 2234 id="Picture_x0020_51" o:spid="_x0000_i1029" type="#_x0000_t75" style='width:465pt; 2306 2235 height:255pt;visibility:visible;mso-wrap-style:square'> 2307 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 85.png"2236 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image060.png" 2308 2237 o:title=""/> 2309 2238 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2310 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 101.gif" v:shapes="Picture_x0020_51"><![endif]></span></p>2239 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image061.gif" v:shapes="Picture_x0020_51"><![endif]></span></p> 2311 2240 2312 2241 <p class=MsoNormal>Select <b style='mso-bidi-font-weight:normal'><span … … 2326 2255 id="Picture_x0020_52" o:spid="_x0000_i1028" type="#_x0000_t75" style='width:465pt; 2327 2256 height:255pt;visibility:visible;mso-wrap-style:square'> 2328 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 87.png"2257 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image062.png" 2329 2258 o:title=""/> 2330 2259 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2331 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 102.gif" v:shapes="Picture_x0020_52"><![endif]></span></p>2260 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image063.gif" v:shapes="Picture_x0020_52"><![endif]></span></p> 2332 2261 2333 2262 <p class=MsoNormal>For the three pull downs, <b style='mso-bidi-font-weight: … … 2354 2283 id="Picture_x0020_53" o:spid="_x0000_i1027" type="#_x0000_t75" style='width:465pt; 2355 2284 height:255pt;visibility:visible;mso-wrap-style:square'> 2356 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 89.png"2285 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image064.png" 2357 2286 o:title=""/> 2358 2287 </v:shape><![endif]--><![if !vml]><img border=0 width=620 height=340 2359 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 103.gif" v:shapes="Picture_x0020_53"><![endif]></span></p>2288 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image065.gif" v:shapes="Picture_x0020_53"><![endif]></span></p> 2360 2289 2361 2290 <p class=MsoNormal>Press <span class=GramE><b style='mso-bidi-font-weight:normal'><span … … 2370 2299 id="Picture_x0020_54" o:spid="_x0000_i1026" type="#_x0000_t75" style='width:243.75pt; 2371 2300 height:120.75pt;visibility:visible;mso-wrap-style:square'> 2372 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 91.png"2301 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image066.png" 2373 2302 o:title=""/> 2374 2303 </v:shape><![endif]--><![if !vml]><img border=0 width=325 height=161 2375 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 104.gif" v:shapes="Picture_x0020_54"><![endif]></span></p>2304 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image067.gif" v:shapes="Picture_x0020_54"><![endif]></span></p> 2376 2305 2377 2306 <p class=MsoNormal>And the plot will show the best fit line in red; it nicely … … 2381 2310 id="Picture_x0020_55" o:spid="_x0000_i1025" type="#_x0000_t75" style='width:469.5pt; 2382 2311 height:334.5pt;visibility:visible;mso-wrap-style:square'> 2383 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image0 93.png"2312 <v:imagedata src="TOF%20Sequential%20Single%20Peak%20Fit_files/image068.png" 2384 2313 o:title=""/> 2385 2314 </v:shape><![endif]--><![if !vml]><img border=0 width=626 height=446 2386 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image 105.gif" v:shapes="Picture_x0020_55"><![endif]></span></p>2315 src="TOF%20Sequential%20Single%20Peak%20Fit_files/image069.gif" v:shapes="Picture_x0020_55"><![endif]></span></p> 2387 2316 2388 2317 <p class=MsoNormal>The resulting <span class=SpellE>Hookes</span> Law 2389 coefficient is 40.38(13<span class=GramE>)x10</span><sup>-6 </sup>MN for this 2390 reflection (austenite 111).<span style='mso-spacerun:yes'> </span>This end the 2391 tutorial; save the project if desired. You can further explore the sequential 2392 results and perhaps extract <span class=SpellE>Hookes</span> Law coefficients 2393 for the other reflections that show no hysteresis. If you want the look at Bank 2394 2 data (the opposite detector) you should start with a fresh GSAS-II project file 2395 and follow this tutorial for it. The ratio of the corresponding slope for the 2396 austenite 111 reflection with what we found here should be the Poisson ratio.</p> 2318 coefficient is 40.38(13<span class=GramE>)x10</span><sup>-6 </sup>MN<sup>-1</sup> 2319 for this reflection (austenite 111).<span style='mso-spacerun:yes'> 2320 </span>This end the tutorial; save the project if desired. You can further 2321 explore the sequential results and perhaps extract <span class=SpellE>Hookes</span> 2322 Law coefficients for the other reflections that show no hysteresis. If you want 2323 the look at Bank 2 data (the opposite detector) you should start with a fresh 2324 GSAS-II project file and follow this tutorial for it. The ratio of the 2325 corresponding slope for the austenite 111 reflection with what we found here 2326 should be the Poisson ratio.</p> 2397 2327 2398 2328 </div>
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