1 | ###################################################################### |
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2 | # User specified information for instrument calibration |
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3 | # |
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4 | # Rule: |
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5 | # 1. '#' indicates a comment line |
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6 | # 2. General information for all banks should be writtten in |
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7 | # the 'BANK = GENERAL' |
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8 | # 3. Bank specific information should be written in the |
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9 | # 'BANK = X ZONE'. |
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10 | # 4. Define a variable as VARIABLENAME = VALUE |
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11 | # |
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12 | ###################################################################### |
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13 | |
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14 | WORKING_BANKID = 1 |
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15 | |
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16 | ##################################################################### |
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17 | BANK = GENERAL |
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18 | ##################################################################### |
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19 | # Directories |
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20 | DataFileDir = |
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21 | HKLFileDir = /home/wzz/Projects/MantidTests/LeBailFit/PG3_2012August/Reflections/ |
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22 | IrfFileDir = /home/wzz/Projects/MantidTests/LeBailFit/PG3_2012August/PeakProfiles/ |
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23 | IrfFileDir2 = /home/wzz/Projects/MantidTests/LeBailFit/Test2013B/AshfiaResult/Bank1/ |
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24 | WorkingDir = |
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25 | |
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26 | # Background |
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27 | BackgroundType = Polynomial |
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28 | BackgroundOrder = 6 |
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29 | |
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30 | ##################################################################### |
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31 | BANK = 1 |
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32 | ##################################################################### |
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33 | DataFileName = PG3_11485-1.dat |
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34 | HKLFileName = LB4844b1.hkl |
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35 | IrfFileName = 2011B_HR60b1.irf |
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36 | IrfFileName2 = 2013A_HR60b1.irf |
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37 | DataWorkspace = PG3_11485 |
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38 | LeBailFitMinTOF = 5053. |
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39 | LeBailFitMaxTOF = 49387. |
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40 | LatticeSize = 4.1568899999999998 |
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41 | UserSpecifiedBkgdPts = 5243,8910,11165,12153,13731,15060,16511,17767,19650,21874,23167,24519,36000,44282,49000 |
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42 | SinglePeakFitMin = 15000. |
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43 | SinglePeakFitMax = 49387. |
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44 | # version 2.0 single peak fitting |
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45 | MinimumSinglePeakHeight = 0.30 |
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46 | MinimumHKLPeakToFit = 12, 12, 12 |
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47 | RightMostSinglePeakHKL = 2, 0, 0 |
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48 | RightMostPeakLeftBound = 46000.0 |
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49 | RightMostPeakRightBound = 48000.0 |
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50 | |
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51 | ##################################################################### |
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52 | BANK = 2 |
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53 | ##################################################################### |
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54 | DataFileName = PG3_11486-2.dat |
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55 | HKLFileName = LB4853b2.hkl |
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56 | IrfFileName = 2011B_HR60b2.irf |
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57 | IrfFileName2 = mantid_b2_15k.irf |
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58 | DataWorkspace = PG3_11486 |
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59 | LeBailFitMinTOF = 7000. |
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60 | LeBailFitMaxTOF = 71260. |
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61 | SinglePeakFitMin = 17322. |
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62 | SinglePeakFitMax = 71260. |
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63 | LatticeSize = 4.1568899999999998 |
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64 | UserSpecifiedBkgdPts = 5243,8910,11165,12153,13731,15060,16511,17767,19650,21874,23167,24519,36000,44282,49000, 60000., 71240 |
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65 | # version 2.0 single peak fitting |
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66 | MinimumSinglePeakHeight = 0.30 |
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67 | MinimumHKLPeakToFit = 12, 12, 12 |
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68 | RightMostSinglePeakHKL = 1, 1, 0 |
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69 | RightMostPeakLeftBound = 65800.0 |
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70 | RightMostPeakRightBound = 67000.0 |
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71 | |
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72 | ##################################################################### |
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73 | BANK = 3 |
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74 | ##################################################################### |
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75 | DataFileName = PG3_11487-3.dat |
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76 | HKLFileName = LB4854b3.hkl |
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77 | IrfFileName = 2011B_HR60b3.irf |
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78 | IrfFileName2 = mantid_b3_15k.irf |
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79 | DataWorkspace = PG3_11487 |
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80 | LeBailFitMinTOF = 10080. |
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81 | LeBailFitMaxTOF = 72000. |
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82 | SinglePeakFitMin = 16866. |
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83 | SinglePeakFitMax = 70000. |
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84 | LatticeSize = 4.1568899999999998 |
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85 | UserSpecifiedBkgdPts = 10082., 10591., 11154., 12615., 13690., 13715., 15073., 16893., 17764., 19628., 21318., 24192., 35350., 44212., 50900., 60000., 69900., 79000. |
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86 | |
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87 | ##################################################################### |
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88 | BANK = 4 |
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89 | ##################################################################### |
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90 | DataFileName = PG3_11488-4.dat |
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91 | HKLFileName = LB4855b4.hkl |
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92 | IrfFileName = 2011B_HR60b4.irf |
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93 | DataWorkspace = PG3_11488 |
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94 | LeBailFitMinTOF = 12949. |
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95 | LeBailFitMaxTOF = 95842. |
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96 | SinglePeakFitMin = 20275. |
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97 | SinglePeakFitMax = 95842. |
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98 | LatticeSize = 4.1568899999999998 |
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99 | UserSpecifiedBkgdPts = 12950., 13352., 13708., 14297., 15050., 16849., 17744., 24132., 30530., 32890., 36903., 44353., 50572., 60000., 80000., 94840. |
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100 | |
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101 | ##################################################################### |
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102 | BANK = 5 |
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103 | ##################################################################### |
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104 | DataFileName = PG3_11489-5.dat |
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105 | HKLFileName = LB4856b5.hkl |
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106 | IrfFileName = 2011B_HR60b5.irf |
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107 | DataWorkspace = PG3_11489 |
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108 | LeBailFitMinTOF = 26444. |
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109 | LeBailFitMaxTOF = 100000. |
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110 | SinglePeakFitMin = 37451. |
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111 | SinglePeakFitMax = 100000. |
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112 | LatticeSize = 4.1568899999999998 |
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113 | UserSpecifiedBkgdPts = 26448., 28951., 30553., 33466., 36372., 40000., 44490., 51035., 60340., 72000., 87540.,96436., 99900. |
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114 | |
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115 | ##################################################################### |
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116 | BANK = 6 |
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117 | ##################################################################### |
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118 | DataFileName = PG3_10813-6.dat |
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119 | HKLFileName = Ada1861b6.hkl |
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120 | IrfFileName = 2011B_HR60b5.irf |
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121 | DataWorkspace = PG3_10813 |
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122 | LeBailFitMinTOF = 12. |
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123 | LeBailFitMaxTOF = 395842. |
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124 | SinglePeakFitMin = 20275. |
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125 | SinglePeakFitMax = 95842. |
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126 | LatticeSize = 4.1568899999999998 |
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127 | UserSpecifiedBkgdPts = 12950., 13352., 13708., 14297., 15050., 16849., 17744., 24132., 30530., 32890., 36903., 44353., 50572., 60000., 80000., 94840. |
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128 | |
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129 | ##################################################################### |
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130 | BANK = 7 |
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131 | ##################################################################### |
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132 | DataFileName = PG3_10812-4.dat |
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133 | HKLFileName = LB4855b4.hkl |
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134 | IrfFileName = 2011B_HR60b4.irf |
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135 | DataWorkspace = PG3_10810 |
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136 | LeBailFitMinTOF = 12949. |
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137 | LeBailFitMaxTOF = 95842. |
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138 | SinglePeakFitMin = 20275. |
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139 | SinglePeakFitMax = 95842. |
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140 | LatticeSize = 4.1568899999999998 |
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141 | UserSpecifiedBkgdPts = 12950., 13352., 13708., 14297., 15050., 16849., 17744., 24132., 30530., 32890., 36903., 44353., 50572., 60000., 80000., 94840. |
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