comparison examples/edd/strain_analysis_config.yaml @ 0:cbbe42422d56 draft

planemo upload for repository https://github.com/CHESSComputing/ChessAnalysisPipeline/tree/galaxy commit 1401a7e1ae007a6bda260d147f9b879e789b73e0-dirty
author kls286
date Tue, 28 Mar 2023 15:07:30 +0000
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comparison
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-1:000000000000 0:cbbe42422d56
1 energy_range:
2 - 54
3 - 112
4 lattice_parameters:
5 - 5.41153
6 material_file: examples/edd/materials.h5
7 material_name: CeO2
8 selected_peaks:
9 - 3
10 - 4
11 - 5
12 - 6
13 - 7
14 - 8
15 - 9
16 - 10
17 - 11
18 - 12
19 - 13
20 tth_max: 90.0
21 tth_tol: 0.15