Searched refs:chemsys_formula_id (Results 1 – 3 of 3) sorted by relevance
| /dports/science/py-pymatgen/pymatgen-2022.0.15/pymatgen/ext/ |
| H A D | matproj.py | 302 def get_data(self, chemsys_formula_id, data_type="vasp", prop=""): argument
325 sub_url = "/materials/%s/%s" % (chemsys_formula_id, data_type)
384 def get_task_data(self, chemsys_formula_id, prop=""): argument
403 sub_url = "/tasks/%s" % chemsys_formula_id
408 def get_structures(self, chemsys_formula_id, final=True): argument
423 data = self.get_data(chemsys_formula_id, prop=prop)
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| /dports/science/py-abipy/abipy-0.9.0/abipy/scripts/ |
| H A D | abistruct.py | 903 mp = abilab.mp_search(options.chemsys_formula_id)
933 if os.path.exists(options.chemsys_formula_id):
934 mp = abilab.mp_match_structure(options.chemsys_formula_id)
939 if options.chemsys_formula_id.startswith("mp-"):
941 mpid = options.chemsys_formula_id
945 mp = abilab.mp_search(options.chemsys_formula_id)
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| /dports/science/py-abipy/abipy-0.9.0/abipy/core/ |
| H A D | structure.py | 79 def mp_search(chemsys_formula_id, api_key=None, endpoint=None): argument
98 chemsys_formula_id = chemsys_formula_id.replace(" ", "")
104 data = rest.get_data(chemsys_formula_id, prop="")
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