1 | <html> |
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2 | <head> |
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3 | <META NAME="Author" CONTENT="Brian H. Toby"> |
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4 | <title>EXPGUI</title> |
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5 | </head> |
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6 | <BODY BGCOLOR="#FFFFFF"> |
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7 | |
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20 | </CENTER></A> |
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21 | <br clear=all><hr> |
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22 | |
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23 | <TABLE BORDER BGCOLOR="#FFFF40" ALIGN=RIGHT> |
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24 | <TR><TH><A Href="expgui.html">EXPGUI top</A> |
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25 | </TH><TH><A Href="expgui4.html">Next page</A> |
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26 | </TH><TH><A Href="expgui2.html">Previous page</A> |
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27 | </TH></TR></TABLE><BR CLEAR=ALL> |
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28 | |
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29 | <center><h1> |
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30 | EXPGUI, part 3 |
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31 | </h1></center> |
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32 | <h3>A.3 Histogram pane</h3> |
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33 | <DL><DL> |
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34 | The histogram pane is used to edit background |
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35 | and diffractometer constants for a histogram, as well as |
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36 | set damping and refinement flags for these parameters. |
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37 | <P> |
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38 | If |
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39 | <A href="expgui.html#multiplehistogram"> |
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40 | "Multiple Histogram Selection" mode</A> is set to "All", |
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41 | this pane is disabled. For other settings of this mode, |
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42 | groups of histograms can be selected and modified |
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43 | collectively. |
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44 | <P> |
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45 | If the EXPTOOL program |
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46 | <A href="expgui.html#installation">(see the installation instructions)</A> |
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47 | is installed, a button for adding histograms will |
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48 | appear on the bottom right on this pane, as seen below. If the |
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49 | program is not properly installed, no errors occur, but the button |
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50 | does not appear. |
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51 | <P> |
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52 | Note that the order that histograms appear in this |
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53 | pane is determined by the <a href="expguic.html#sorthist">"Sort histograms by"</a> option in |
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54 | the Options Menu. |
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55 | </DL></DL> |
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56 | <img SRC="3.gif" align=TEXTTOP alt="EXPGUI Screen snapshot"> |
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57 | <P> |
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58 | <DL><DL> |
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59 | If there is more than one phase present in the refinement, |
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60 | an extra box appears at the top of the pane to allow phase flags |
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61 | to be selected. This allows a phase to be used in some histograms |
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62 | but not in others. It also offers a simple way to effectively "delete" a |
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63 | phase by removing it from all histograms. Be sure to rerun POWPREF after |
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64 | changing the phase flags. |
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65 | </DL></DL> |
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66 | <img SRC="3a.gif" align=TEXTTOP alt="EXPGUI Screen snapshot"> |
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67 | <br clear=all> |
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68 | <P> |
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69 | <DL><DL> |
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70 | The pane appears slightly differently when |
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71 | <A href="expgui.html#multiplehistogram"> |
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72 | "Multiple Histogram Selection" mode</A> is set to a single histogram type. |
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73 | In this case diffractometer constants are edited in separate windows (see |
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74 | <a href="#EditParm">Global Editing of Parameters</a>, below). |
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75 | <P> |
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76 | </DL></DL> |
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77 | <img SRC="3c.gif" align=TEXTTOP alt="EXPGUI Screen snapshot"> |
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78 | <br clear=all> |
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79 | |
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80 | <a name="EditBackground"></a> |
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81 | <h3>A.3.1 Editing background</h3> |
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82 | <DL><DL> |
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83 | <img SRC="3b.gif" align=TEXTOP alt="EXPGUI Screen snapshot"> |
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84 | When the button labeled "Edit Background", (or "Globally Edit Background" |
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85 | or in the case where <A href="expgui.html#multiplehistogram"> |
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86 | "Multiple Histogram Selection" mode</A> is set to a single histogram type) |
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87 | is pressed, a window such as the one |
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88 | to the left is displayed. In the case where background coefficients |
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89 | are being edited for more than one histogram |
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90 | (<A href="expgui.html#multiplehistogram"> |
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91 | "Multiple Histogram Selection" mode</A> must be |
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92 | set to a single histogram type) the entry boxes will appear blank |
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93 | and only those terms that are filled in will be changed when the "Set" |
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94 | button is pressed. |
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95 | This option is mostly useful when changing the background function or the |
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96 | number of terms for several histograms at a single time. |
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97 | Note that no changes are made until the "Set" |
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98 | button is pressed. |
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99 | <P> |
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100 | <IMG SRC="new.gif" HEIGHT=13 WIDTH=36 alt="New!"> |
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101 | The "Fit Background Graphically" button is displayed only when a single |
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102 | histogram is selected for background editing. When this button is |
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103 | pressed, the <A HREF="liveplot.html#bkgedit">BKGEDIT</A> program is |
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104 | called to fit a background function to user-input fixed background points. |
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105 | See the <A HREF="liveplot.html#bkgedit">BKGEDIT documentation</A> for more |
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106 | information. |
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107 | |
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108 | <br clear=all> |
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109 | </DL></DL> |
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110 | |
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111 | <a name="EditParm"></a> |
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112 | <h3>A.3.2 Global Editing of Parameters</h3> |
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113 | <DL><DL> |
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114 | <img SRC="3d.gif" align=LEFT alt="EXPGUI Screen snapshot"> |
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115 | The dialog to the left shows how |
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116 | a difractometer constant can be |
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117 | edited for more than one histogram |
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118 | (<A href="expgui.html#multiplehistogram"> |
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119 | "Multiple Histogram Selection" mode</A> must be |
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120 | set to a single histogram type). |
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121 | This menu is also used to globally set the |
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122 | <A href="expgui4.html">Phase Fraction</A>. |
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123 | <br clear=all> |
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124 | |
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125 | </DL></DL> |
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126 | |
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127 | <a name="AddHist"></a> |
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128 | <h3>A.3.3 Entering New Diffractograms</h3> |
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129 | <DL><DL> |
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130 | <img SRC="3e.gif" align=LEFT alt="EXPGUI Screen snapshot"> |
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131 | Pressing the "Add New Histogram" button creates the dialog |
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132 | to the left. A data file and an instrument parameter file are |
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133 | selected using the "Select File" buttons. If more than |
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134 | one bank is defined, the bank must be selected and the maximum |
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135 | data value to be considered, must be entered. Note that the |
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136 | units for the maximum (minimum for d-spaces) must also be selected. |
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137 | To view a data file, to see the extent of the data, the "Run RAWPLOT" |
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138 | button may be used. Note that EXPGUI cannot communicate the names |
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139 | of the data and instrument parameter files to RAWPLOT, so they must be |
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140 | reentered. |
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141 | <P> |
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142 | <a name="AddHistErr"></a> |
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143 | If errors are detected in the input, an error message is displayed detailing where |
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144 | the errors are found. Otherwise, the EXPTOOL program is run. |
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145 | |
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146 | and the output is displayed |
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147 | </DL></DL> |
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148 | <hr> |
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149 | <TABLE BORDER BGCOLOR="#FFFF40" ALIGN=RIGHT> |
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150 | <TR><TH><A Href="expgui.html">EXPGUI top</A> |
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151 | </TH><TH><A Href="expgui4.html">Next page</A> |
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152 | </TH><TH><A Href="expgui2.html">Previous page</A> |
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153 | </TH></TR></TABLE> |
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154 | |
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155 | <a href="http://www.ncnr.nist.gov/staff/toby/">Brian Toby</a> (<a href="mailto:brian.toby@nist.gov">Brian.Toby@NIST.GOV</a>) |
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156 | <br> |
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157 | $Revision: 402 $ $Date: 2009-12-04 23:05:34 +0000 (Fri, 04 Dec 2009) $ |
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158 | </body> |
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159 | </html> |
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