Révision e1c5f171 modules/formats.py
b/modules/formats.py | ||
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183 | 183 |
atoms_list = [] |
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for conf in conf_list: |
185 | 185 |
if code == 'cp2k': |
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read_coords_cp2k(glob(f"{run_type}/{conf}/*-1.restart")[0],
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spec_atms)
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atoms_list.append(read_coords_cp2k(glob(f"{run_type}/{conf}/*-1"
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f".restart")[0], spec_atms))
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# elif code == 'vasp' |
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return atoms_list |
190 | 190 |
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