uploading HB1A calibration data IPTS-9879 exp978

test_data/exp978/Calibration/si23May2023_52601PM

@@ -0,0 +1,70 @@
+[Powder]
+name="si"
+dspacing=5.430900
+energy=14.600000
+emeasured=14.450300
+npeaks=4
+
+[Peak1]
+h=1.000000
+k=1.000000
+l=1.000000
+position=-44.666980
+error=0.004826
+xvals="-46.999700,-46.849000,-46.698500,-46.547500,-46.397700,-46.249100,-46.102000,-45.950800,-45.800600,-45.651700,-45.498900,-45.349600,-45.199400,-45.051300,-44.897100,-44.749500,-44.600700,-44.452100,-44.301600,-44.152700,-44.001300,-43.849300,-43.698900,-43.549400,-43.397500,-43.247700,-43.098500,-42.950000,-42.801400,-42.650800,-42.500400"
+yvals="19.000000,33.000000,35.000000,33.000000,27.000000,26.000000,32.000000,37.000000,72.000000,136.000000,302.000000,550.000000,902.000000,1239.000000,1516.000000,1723.000000,1841.000000,1689.000000,1318.000000,922.000000,540.000000,305.000000,139.000000,77.000000,50.000000,31.000000,31.000000,42.000000,28.000000,29.000000,36.000000"
+errs="4.358899,5.744563,5.916080,5.744563,5.196152,5.099020,5.656854,6.082763,8.485281,11.661904,17.378147,23.452079,30.033315,35.199432,38.935845,41.509035,42.906876,41.097445,36.304270,30.364453,23.237900,17.464249,11.789826,8.774964,7.071068,5.567764,5.567764,6.480741,5.291503,5.385165,6.000000"
+fitvals="27.812201,27.814550,27.828213,27.898384,28.208801,29.398975,33.347903,45.422099,76.751538,146.735555,287.598997,518.780784,848.469458,1230.469598,1598.071277,1815.885083,1828.090074,1628.337258,1279.515328,893.526557,551.385100,305.358550,158.127010,81.987848,47.334059,34.094261,29.603081,28.265435,27.913159,27.831348,27.815123"
+coefficients="27.811810,1822.680318,-44.666980,0.992449"
+coefficient_errors="1.813097,24.717238,0.004826,0.009184"
+chisq=1.493324
+scan=15
+
+[Peak2]
+h=2.000000
+k=2.000000
+l=0.000000
+position=-76.667493
+error=0.038828
+xvals="-79.498200,-79.298400,-79.098100,-78.900000,-78.702100,-78.501600,-78.300400,-78.097700,-77.902800,-77.698700,-77.498600,-77.299800,-77.099100,-76.898600,-76.700300,-76.498200,-76.298400,-76.097700,-75.898100,-75.699400,-75.500700,-75.303700,-75.103500,-74.901000,-74.699000,-74.498700,-74.297200,-74.097800,-73.901800,-73.699800,-73.500200"
+yvals="69.000000,125.000000,158.000000,215.000000,216.000000,210.000000,159.000000,225.000000,343.000000,574.000000,751.000000,982.000000,991.000000,1194.000000,1231.000000,1275.000000,1203.000000,1106.000000,956.000000,776.000000,534.000000,271.000000,127.000000,66.000000,48.000000,35.000000,36.000000,39.000000,35.000000,62.000000,109.000000"
+errs="8.306624,11.180340,12.569805,14.662878,14.696938,14.491377,12.609520,15.000000,18.520259,23.958297,27.404379,31.336879,31.480152,34.554305,35.085610,35.707142,34.684290,33.256578,30.919250,27.856777,23.108440,16.462078,11.269428,8.124038,6.928203,5.916080,6.000000,6.244998,5.916080,7.874008,10.440307"
+fitvals="51.350668,52.668148,55.906435,63.124870,78.063805,107.091970,158.662456,243.088352,362.628161,530.334267,728.999319,939.737111,1135.017395,1277.627932,1338.815211,1306.195042,1186.684413,1004.090622,794.259018,590.059128,414.227003,279.339128,183.230601,121.443375,85.726589,66.855788,57.545626,53.380136,51.652308,50.959423,50.716088"
+coefficients="50.601721,1289.505927,-76.667493,1.726786"
+coefficient_errors="12.921980,77.274087,0.038828,0.082920"
+chisq=25.981948
+scan=16
+
+[Peak3]
+h=1.000000
+k=1.000000
+l=3.000000
+position=-93.196232
+error=0.028665
+xvals="-97.000700,-96.749500,-96.500300,-96.248800,-95.996200,-95.748600,-95.496800,-95.249400,-94.998300,-94.752000,-94.499800,-94.250600,-94.000000,-93.746800,-93.503100,-93.249300,-92.996000,-92.748100,-92.501400,-92.250700,-92.000600,-91.753100,-91.499100,-91.248700,-90.998900,-90.748000,-90.500100,-90.253300,-89.998400,-89.747600,-89.500600,-89.247900,-89.000700"
+yvals="63.000000,70.000000,69.000000,73.000000,96.000000,84.000000,133.000000,249.000000,471.000000,716.000000,1007.000000,1263.000000,1516.000000,1578.000000,1822.000000,1867.000000,1919.000000,1868.000000,1762.000000,1466.000000,1250.000000,940.000000,523.000000,229.000000,123.000000,90.000000,73.000000,69.000000,64.000000,65.000000,70.000000,60.000000,71.000000"
+errs="7.937254,8.366600,8.306624,8.544004,9.797959,9.165151,11.532563,15.779734,21.702534,26.758176,31.733263,35.538711,38.935845,39.724048,42.684892,43.208795,43.806392,43.220366,41.976184,38.288379,35.355339,30.659419,22.869193,15.132746,11.090537,9.486833,8.544004,8.306624,8.000000,8.062258,8.366600,7.745967,8.426150"
+fitvals="52.657166,54.124874,57.623091,65.526467,82.117778,113.474798,170.499934,263.184047,406.867205,604.813646,865.600055,1166.689058,1482.577106,1771.120914,1974.776218,2071.227454,2031.299219,1867.981795,1613.346975,1304.577913,992.130518,714.516097,484.060314,316.896935,204.028337,133.323700,92.963920,71.325059,60.235367,55.247417,53.133073,52.266894,51.951903"
+coefficients="51.789785,2022.489850,-93.196232,2.274947"
+coefficient_errors="9.838429,68.602142,0.028665,0.058948"
+chisq=14.373357
+scan=17
+
+[Peak4]
+h=0.000000
+k=0.000000
+l=4.000000
+position=-122.264351
+error=0.056126
+xvals="-128.897900,-128.597200,-128.296100,-128.002900,-127.700100,-127.401400,-127.098600,-126.797300,-126.496200,-126.203200,-125.898700,-125.598300,-125.298100,-125.000000,-124.702800,-124.401800,-124.099200,-123.798600,-123.498100,-123.201300,-122.898700,-122.599900,-122.298800,-122.000300,-121.701500,-121.399300,-121.103700,-120.801600,-120.498500,-120.196500,-119.899100,-119.603600,-119.301000,-118.998500,-118.699600,-118.396900,-118.102300,-117.801900,-117.498000,-117.198900,-116.899900,-116.601300,-116.300900,-115.999700"
+yvals="146.000000,181.000000,179.000000,177.000000,182.000000,149.000000,140.000000,153.000000,175.000000,222.000000,252.000000,308.000000,395.000000,492.000000,681.000000,699.000000,805.000000,836.000000,944.000000,1017.000000,1053.000000,1131.000000,1112.000000,1127.000000,1139.000000,1082.000000,1032.000000,955.000000,916.000000,835.000000,712.000000,554.000000,379.000000,250.000000,185.000000,150.000000,174.000000,166.000000,206.000000,152.000000,184.000000,204.000000,193.000000,219.000000"
+errs="12.083046,13.453624,13.379088,13.304135,13.490738,12.206556,11.832160,12.369317,13.228757,14.899664,15.874508,17.549929,19.874607,22.181073,26.095977,26.438608,28.372522,28.913665,30.724583,31.890437,32.449961,33.630343,33.346664,33.570821,33.749074,32.893768,32.124757,30.903074,30.265492,28.896367,26.683328,23.537205,19.467922,15.811388,13.601471,12.247449,13.190906,12.884099,14.352700,12.328828,13.564660,14.282857,13.892444,14.798649"
+fitvals="150.857784,151.433623,152.480487,154.257994,157.365282,162.403501,170.522952,182.953600,201.390823,226.968011,263.632914,311.887254,373.692883,449.260197,538.228370,640.174552,750.805200,863.190861,971.057920,1065.700912,1142.479370,1192.401411,1212.253901,1199.996455,1156.970130,1086.012661,995.756066,889.542459,776.616779,665.074705,562.037926,470.447977,390.256938,324.672975,273.676153,234.564206,206.726993,186.662894,172.890486,164.005237,158.357628,154.888325,152.813647,151.620229"
+coefficients="150.241963,1062.223763,-122.264351,4.045857"
+coefficient_errors="11.865004,36.862895,0.056126,0.142653"
+chisq=9.600280
+scan=18
+
+[Final]
+m2zero=-0.194951
+s2zero=-0.116678

test_data/exp978/Calibration/si23May2023_52601PM.out

@@ -0,0 +1,31 @@
+Performing calibration using si(d-spacing=5.430900) with the following data:
+
+    h    k    l      d-spacing     position
+ 1.00 1.00 1.00        3.13553     -44.666980+/-0.004826
+ 2.00 2.00 0.00        1.92011     -76.667493+/-0.038828
+ 1.00 1.00 3.00        1.63748     -93.196232+/-0.028665
+ 0.00 0.00 4.00        1.35773     -122.264351+/-0.056126
+Results of the fit:
+
+Chi-Squared = 1.597224
+
+    h    k    l    Fit Position
+ 1.00 1.00 1.00      -44.667716
+ 2.00 2.00 0.00      -76.603511
+ 1.00 1.00 3.00      -93.195251
+ 0.00 0.00 4.00     -122.302196
+
+Best fit parameters:
+lambda=2.377114+/-0.000764  (Energy=14.476897 meV).
+
+The calculated zero angle for m2 is:
+m2_old - m2_calc + m2_zero_old = 41.536674-41.496739+-0.234886 = -0.194951
+Command:      zero m2 -0.194951
+
+
+The s2 offset angle is: 0.116678+/-0.017351
+The calculated zero angle for s2 is:
+
+s2_zero_old - s2_offset = 0.000000 - 0.116678 = -0.116678
+Command:      zero s2 -0.116678
+