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Last change
on this file since 4207 was
4207,
checked in by toby, 3 years ago
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add density to scripting
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-
Property svn:executable set to
*
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File size:
1.0 KB
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| 1 | # GSAS-II phase information template file |
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| 2 | |
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| 3 | data_Phase_Template |
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| 4 | #============================================================================== |
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| 5 | # 7. CHEMICAL, STRUCTURAL AND CRYSTAL DATA |
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| 6 | |
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| 7 | _pd_char_particle_morphology ? |
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| 8 | |
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| 9 | _chemical_name_systematic |
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| 10 | ; ? |
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| 11 | ; |
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| 12 | _chemical_name_common ? |
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| 13 | _chemical_formula_moiety ? |
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| 14 | _chemical_formula_structural ? |
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| 15 | _chemical_formula_analytical ? |
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| 16 | _chemical_melting_point ? |
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| 17 | _chemical_compound_source ? # for minerals and |
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| 18 | # natural products |
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| 19 | _symmetry_space_group_name_Hall ? |
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| 20 | |
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| 21 | _exptl_crystal_F_000 ? |
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| 22 | _exptl_crystal_density_meas ? |
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| 23 | _exptl_crystal_density_method ? |
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| 24 | |
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| 25 | _cell_measurement_temperature ? |
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| 26 | |
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| 27 | _cell_special_details |
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| 28 | ; ? |
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| 29 | ; |
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| 30 | |
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| 31 | _geom_special_details ? |
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| 32 | |
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| 33 | # The following item identifies the program(s) used (if appropriate). |
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| 34 | _computing_structure_solution ? |
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| 35 | |
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| 36 | #============================================================================== |
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| 37 | |
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| 38 | # 8. Phase information from GSAS-II |
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| 39 | |
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