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comparison test-data/fit_report.txt @ 7:e0407f36fcea draft default tip

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planemo upload for repository https://github.com/MaterialsGalaxy/larch-tools/tree/main/larch_artemis commit 7f52c8654581d23a2acffc818e0c197cf8e04504
author muon-spectroscopy-computational-project
date Tue, 03 Sep 2024 11:51:27 +0000
parents 7acb53ffb96f
children
comparison
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6:d17c5d62802f 7:e0407f36fcea
1 =================== FEFFIT RESULTS ==================== 1 =================== FEFFIT RESULTS ====================
2 \[\[Statistics\]\] 2 \[\[Statistics\]\]
3 n_function_calls = 4\d\d 3 n_function_calls = \d{3}
4 n_variables = 6 4 n_variables = 6
5 n_data_points = 104 5 n_data_points = 104
6 n_independent = 12\.2045080 6 n_independent = 12\.2045080
7 chi_square = [\d\.]{10} 7 chi_square = [\d\.]{10}
8 reduced chi_square = [\d\.]{10} 8 reduced chi_square = [\d\.]{10}
35 \w+, \w+\s+= [\s\-]0\.\d{3} 35 \w+, \w+\s+= [\s\-]0\.\d{3}
36 \w+, \w+\s+= [\s\-]0\.\d{3} 36 \w+, \w+\s+= [\s\-]0\.\d{3}
37 37
38 38
39 \[\[Dataset\]\] 39 \[\[Dataset\]\]
40 unique_id = 'dm7xe57x' 40 unique_id = '\w{8}'
41 fit space = 'r' 41 fit space = 'r'
42 r-range = 1\.400, 3\.000 42 r-range = 1\.400, 3\.000
43 k-range = 3\.000, 14\.000 43 k-range = 3\.000, 14\.000
44 k window, dk = 'hanning', 1\.000 44 k window, dk = 'hanning', 1\.000
45 paths used in fit = \['feff/feff0001\.dat', 'feff/feff0002\.dat', 'feff/feff0003\.dat', 'feff/feff0004\.dat'\] 45 paths used in fit = \['feff/feff0001\.dat', 'feff/feff0002\.dat', 'feff/feff0003\.dat', 'feff/feff0004\.dat'\]
46 k-weight = 2 46 k-weight = 2
47 epsilon_k = Array\(mean=5\.1913e-4, std=4\.5676e-4\) 47 epsilon_k = Array\(mean=5\.\d{4}e-4, std=4\.5\d{3}e-4\)
48 epsilon_r = [\d\.]{9} 48 epsilon_r = [\d\.]{9}
49 n_independent = 12\.205 49 n_independent = 12\.205
50 50
51 \[\[Paths\]\] 51 \[\[Paths\]\]
52 = Path 'S1' = Rh K Edge 52 = Path 'S1' = Rh K Edge