1 | # $Revision: 23 $ $Date: 2009-12-04 22:59:04 +0000 (Fri, 04 Dec 2009) $ |
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2 | # menu information for GSAS programs |
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3 | |
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4 | # implement |
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5 | # next |
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6 | # previous |
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7 | # newest |
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8 | # help |
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9 | |
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10 | # menu items to be created (N.B. File, Options & Help already exist) |
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11 | set expgui(menunames) {Powder Xtal Graphs Results Calc Import/Export} |
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12 | |
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13 | # contents of each menu |
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14 | array set expgui_menulist { |
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15 | file { |
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16 | New_expnam |
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17 | convert |
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18 | dlst |
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19 | } |
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20 | option { |
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21 | {liveplot_options} |
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22 | } |
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23 | powder { |
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24 | expedt |
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25 | powpref |
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26 | genles |
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27 | powplot |
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28 | rawplot |
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29 | fitspec |
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30 | tofnorm |
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31 | } |
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32 | xtal { |
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33 | expedt |
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34 | genles |
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35 | scabs |
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36 | scmerge |
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37 | sxtldata |
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38 | } |
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39 | graphs { |
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40 | forplot |
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41 | polfplot |
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42 | powplot |
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43 | ortep |
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44 | rawplot |
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45 | fourier |
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46 | forsrh |
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47 | forplot |
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48 | liveplot |
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49 | widplt |
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50 | } |
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51 | calc { |
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52 | cllchg |
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53 | fprime |
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54 | hklgen |
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55 | rducll |
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56 | spcgroup |
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57 | unimol |
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58 | } |
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59 | import/export { |
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60 | exp2shelx |
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61 | exp2xtl |
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62 | gsas2cif |
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63 | hklsort |
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64 | pubtable |
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65 | convert |
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66 | cad4rd |
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67 | dbwscnv |
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68 | x17bcnv |
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69 | p3r3data |
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70 | sxtldata |
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71 | } |
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72 | results { |
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73 | bijcalc |
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74 | disagl |
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75 | reflist |
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76 | geometry |
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77 | hstdmp |
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78 | istats |
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79 | rcalc |
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80 | composition |
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81 | sexp |
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82 | slst |
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83 | lstview |
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84 | last_r |
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85 | } |
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86 | } |
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87 | |
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88 | array set expgui_cmdlist { |
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89 | |
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90 | Save {- { |
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91 | Saves modifications to the current experiment file to disk} |
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92 | } |
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93 | |
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94 | {Save As} {- { |
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95 | Saves modifications to the current experiment file to disk |
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96 | under a new file name } |
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97 | } |
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98 | |
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99 | {Reread .EXP file} {- { |
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100 | Reread the last saved version of the experiment file from disk. |
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101 | |
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102 | This causes any unsaved changes to be lost.} |
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103 | } |
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104 | |
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105 | {Sort atoms by} {- { |
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106 | Determines the order that atoms are displayed on the "Phase" page |
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107 | Atoms may be displayed sorted by atom number, atom type, |
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108 | or by x, y or z} |
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109 | } |
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110 | |
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111 | {Sort histograms by} {- { |
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112 | Determines the order that histograms are displayed on the |
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113 | Histogram, Scaling and Profile pages |
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114 | |
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115 | Histograms may be sorted by histogram number, histogram type, |
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116 | original bank number, or diffraction angle/wavelength} |
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117 | } |
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118 | |
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119 | {Multiple hist. selection} {- { |
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120 | When this mode is off, it is possible to modify parameters |
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121 | and refinement flags for only a single histogram. For other settings, |
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122 | it is possible to modify parameters and flags for groups of |
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123 | histograms (see help for Mouse actions). |
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124 | |
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125 | It does not make sense, however, to globally modify |
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126 | instrument-related parameters and flags for different histogram types. |
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127 | So global actions can be limited to a single class of histogram types |
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128 | (e.g. TOF, CW Neutron,...) which allows these parameters to be set |
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129 | for groups of similar histograms. Thus, if this mode is set to "All" |
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130 | the Histogram and Profile pages are disabled.} |
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131 | } |
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132 | |
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133 | {Mouse actions} {- { |
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134 | A range of atoms or (in multiple selection mode) histograms may be |
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135 | selected by dragging (holding down) the left mouse button. It is also |
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136 | possible to select a range by using the Shift key with the |
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137 | left mouse button. To select or deselect individual entries, use the |
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138 | Control key with the left mouse button. The right mouse button selects |
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139 | all entries.} |
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140 | } |
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141 | |
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142 | expnam {readnewexp { |
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143 | Select an existing GSAS experiment to be used} |
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144 | } |
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145 | |
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146 | New_expnam {CreateNewExp { |
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147 | Create a new GSAS experiment from scratch} |
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148 | } |
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149 | |
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150 | {archive EXP} {- { |
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151 | Toggles archiving of .EXP files. When on, files are |
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152 | saved prior to each save or run of expedt in a file named |
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153 | |
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154 | <expnam>.EXP.xxx.gz where xxx = 000, 001 (UNIX) |
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155 | |
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156 | or in a file named <expnam>.ZIP or <expnam>.xxx (Windows) } |
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157 | } |
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158 | |
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159 | showhelp {showhelp { |
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160 | Show the help information for commands and actions} |
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161 | } |
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162 | |
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163 | powpref {{runGSASwEXP $cmd} { |
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164 | Powder data preparation} |
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165 | } |
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166 | |
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167 | bijcalc {{runGSASwEXP $cmd} { |
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168 | Thermal parameter analysis} |
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169 | } |
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170 | |
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171 | powplot {{runGSASwEXP $cmd} { |
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172 | Display powder patterns} |
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173 | } |
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174 | |
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175 | cllchg {{runGSASwEXP $cmd} { |
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176 | Transform unit cell} |
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177 | } |
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178 | |
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179 | expedt {{runGSASwEXP $cmd} { |
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180 | Run GSAS experiment editor} |
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181 | } |
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182 | |
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183 | genles {{runGSASwEXP $cmd} { |
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184 | Run General Least Squares program} |
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185 | } |
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186 | |
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187 | disagl {{runGSASwEXP $cmd} { |
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188 | Distance/angle calculations} |
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189 | } |
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190 | |
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191 | forplot {{runGSASwEXP $cmd} { |
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192 | Display Fourier maps} |
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193 | } |
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194 | |
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195 | hstdmp {{runGSASwEXP $cmd} { |
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196 | List powder histogram data} |
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197 | } |
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198 | |
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199 | cad4rd {{runGSASwEXP $cmd} { |
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200 | Prepare CAD4 single crystal data} |
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201 | } |
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202 | |
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203 | fourier {{runGSASwEXP $cmd} { |
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204 | Generate Fourier map} |
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205 | } |
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206 | |
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207 | geometry {{runGSASwEXP $cmd} { |
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208 | Molecular geometry calculations} |
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209 | } |
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210 | |
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211 | ortep {{runGSASwEXP $cmd} { |
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212 | Draw crystal structure} |
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213 | } |
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214 | |
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215 | rawplot {{runGSASprog $cmd} { |
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216 | Plot powder data} |
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217 | } |
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218 | |
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219 | |
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220 | p3r3data {{runGSASwEXP $cmd} { |
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221 | Prepare Siemens P3R3 single crystal data} |
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222 | } |
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223 | |
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224 | forsrh {{runGSASwEXP $cmd} { |
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225 | Search Fourier map} |
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226 | } |
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227 | |
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228 | hklsort {{runGSASwEXP $cmd} { |
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229 | Prepare HKL tables} |
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230 | } |
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231 | |
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232 | polfplot {{runGSASwEXP $cmd} { |
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233 | Display polefigures} |
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234 | } |
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235 | |
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236 | rducll {{runGSASprog $cmd} { |
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237 | Unit cell reduction} |
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238 | } |
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239 | |
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240 | sxtldata {{runGSASwEXP $cmd} { |
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241 | Prepare generic single crystal data} |
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242 | } |
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243 | |
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244 | scabs {{runGSASwEXP $cmd} { |
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245 | Single crystal absorption} |
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246 | } |
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247 | |
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248 | istats {{runGSASwEXP $cmd} { |
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249 | HKL Intensity statistics} |
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250 | } |
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251 | |
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252 | reflist {{runGSASwEXP $cmd} { |
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253 | List reflection data} |
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254 | } |
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255 | |
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256 | scmerge {{runGSASwEXP $cmd} { |
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257 | Sort and merge single crystal data} |
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258 | } |
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259 | |
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260 | pubtable {{runGSASwEXP $cmd} { |
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261 | Prepare atom parameter tables} |
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262 | } |
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263 | |
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264 | spcgroup {{runGSASprog $cmd} { |
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265 | Space group symbol interpreter} |
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266 | } |
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267 | |
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268 | rcalc {{runGSASwEXP $cmd} { |
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269 | Compute reflection resuduals} |
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270 | } |
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271 | |
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272 | unimol {{runGSASwEXP $cmd} { |
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273 | Unique molecule assembler} |
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274 | } |
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275 | |
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276 | gsas2cif {{runGSASwEXP $cmd} { |
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277 | Prepare IUCr crystallographic information (CIF) file} |
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278 | } |
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279 | |
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280 | fitspec {{runGSASprog $cmd} { |
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281 | Fit a TOF vanadium scattering spectrum} |
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282 | } |
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283 | |
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284 | tofnorm {{runGSASprog $cmd} { |
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285 | Normalize a TOF spectrum} |
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286 | } |
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287 | |
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288 | fprime {{runGSASprog $cmd} { |
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289 | Compute f, f', f'' and mu/rho for an element for a range of x-ray wavelengths} |
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290 | } |
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291 | |
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292 | dbwscnv {{runGSASprog $cmd} { |
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293 | Convert a data file from DBWS format} |
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294 | } |
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295 | |
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296 | x17bcnv {{runGSASprog $cmd} { |
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297 | Convert an energy dispersive diffractogram data file from NSLS X17b} |
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298 | } |
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299 | |
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300 | liveplot {{liveplot} { |
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301 | Create a plot of powder data (automatically updated) } |
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302 | } |
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303 | |
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304 | {liveplot_options} {liveplotopt { |
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305 | Used to set options for liveplot, for example, the histogram plotted} |
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306 | } |
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307 | |
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308 | convert {{convfile} { |
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309 | Convert a standard ASCII file to the direct access format used by GSAS (and for UNIX, the reverse)} |
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310 | } |
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311 | |
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312 | lstview {lstview { |
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313 | Create a box with scrollbars containing the current .LST file} |
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314 | } |
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315 | |
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316 | widplt {widplt { |
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317 | Displays the FWHM as a function of Q, 2Theta,... for UVWXY values input or read from an EXP file} |
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318 | } |
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319 | |
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320 | } |
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321 | |
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322 | # not implemented (yet) |
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323 | # newest {} |
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324 | #composition {{} {}} |
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325 | #exp2shelx {{} {}} |
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326 | #exp2xtl {{} {}} |
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327 | #newEXP {{newexp} {}} |
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328 | #next {{next 1} {}} |
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329 | #previous {{next 0} {}} |
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330 | #dlst {{delconf .LST} {}} |
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331 | |
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332 | set expgui(buttonlist) { |
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333 | expnam |
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334 | expedt |
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335 | genles |
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336 | powpref |
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337 | powplot |
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338 | lstview |
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339 | liveplot |
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340 | } |
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341 | |
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342 | array set helplist { |
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343 | newEXP Create a new GSAS experiment |
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344 | dlst Delete experiment list file |
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345 | exit Exit GSAS |
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346 | next Advance to next experiment file in list |
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347 | previous Move to previous experiment file in list |
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348 | } |
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