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NaCl.gr
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5028 lines (5023 loc) · 77.1 KB
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[DEFAULT]
version = pdfgetx3-1.1.post2
# input and output specifications
dataformat = twotheta
inputfile = NaCl_ramp01_10f_200ms_0973.chi
backgroundfile =
outputtype = gr
# PDF calculation setup
mode = xray
wavelength = 0.21281
composition = NaCl
bgscale = 1
rpoly = 0.7
qmaxinst = 23
qmin = 0.01
qmax = 21
rmin = 0.01
rmax = 50
rstep = 0.01
# End of config --------------------------------------------------------------
#### start data
#S 1
#L r($\AA$) G($\AA^{-2}$)
0.01 0.00100824
0.02 0.00203904
0.03 0.00310876
0.04 0.00422502
0.05 0.00538342
0.06 0.00656523
0.07 0.00773621
0.08 0.00884672
0.09 0.00983321
0.1 0.0106211
0.11 0.0111288
0.12 0.0112731
0.13 0.0109596
0.14 0.0101118
0.15 0.00870142
0.16 0.00670869
0.17 0.00414586
0.18 0.00106172
0.19 -0.00245506
0.2 -0.00627441
0.21 -0.0102253
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0.25 -0.0227007
0.26 -0.0235301
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0.31 -0.000694183
0.32 0.0104079
0.33 0.0237586
0.34 0.0392187
0.35 0.0565539
0.36 0.0754342
0.37 0.0954366
0.38 0.116052
0.39 0.136641
0.4 0.156522
0.41 0.175
0.42 0.191358
0.43 0.204884
0.44 0.214891
0.45 0.220742
0.46 0.221874
0.47 0.217823
0.48 0.208239
0.49 0.192909
0.5 0.171767
0.51 0.144617
0.52 0.111968
0.53 0.0743574
0.54 0.0323897
0.55 -0.0131885
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0.72 -0.42209
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0.95 -0.0890666
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2.42 -0.173492
2.43 -0.187625
2.44 -0.203527
2.45 -0.220457
2.46 -0.237581
2.47 -0.253999
2.48 -0.26877
2.49 -0.280938
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2.55 -0.249192
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2.57 -0.184325
2.58 -0.140756
2.59 -0.0900485
2.6 -0.0326417
2.61 0.0308543
2.62 0.099671
2.63 0.172898
2.64 0.24955
2.65 0.328451
2.66 0.408237
2.67 0.487659
2.68 0.565459
2.69 0.640398
2.7 0.711285
2.71 0.777001
2.72 0.836524
2.73 0.888951
2.74 0.933513
2.75 0.969589
2.76 0.99672
2.77 1.01412
2.78 1.022
2.79 1.02058
2.8 1.01008
2.81 0.990872
2.82 0.963455
2.83 0.928451
2.84 0.886583
2.85 0.838653
2.86 0.785529
2.87 0.728117
2.88 0.667348
2.89 0.604133
2.9 0.539399
2.91 0.47415
2.92 0.409213
2.93 0.345352
2.94 0.28326
2.95 0.223547
2.96 0.166738
2.97 0.113265
2.98 0.063472
2.99 0.0176084
3 -0.0241639
3.01 -0.061769
3.02 -0.0950302
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3.04 -0.149301
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3.44 -0.379869
3.45 -0.37179
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3.76 0.0331208
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3.78 0.196909
3.79 0.287396
3.8 0.382314
3.81 0.480601
3.82 0.581081
3.83 0.682484
3.84 0.783469
3.85 0.882653
3.86 0.978637
3.87 1.07003
3.88 1.1555
3.89 1.23375
3.9 1.30313
3.91 1.36278
3.92 1.41196
3.93 1.44993
3.94 1.47615
3.95 1.49025
3.96 1.49205
3.97 1.48159
3.98 1.45906
3.99 1.42489
4 1.37964
4.01 1.32407
4.02 1.25893
4.03 1.18498
4.04 1.10385
4.05 1.01676
4.06 0.924948
4.07 0.829689
4.08 0.732256
4.09 0.633895
4.1 0.535806
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4.13 0.254058
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