Searched refs:herm_symbol (Results 1 – 3 of 3) sorted by relevance
| /dports/science/py-abipy/abipy-0.9.0/abipy/core/ |
| H A D | symmetries.py | 986 herm_symbol, ptg_num, trans_mat = spglib.get_pointgroup(rotations)
988 self.herm_symbol = herm_symbol.strip()
998 …return "%s: %s, %s (%d)" % (self.__class__.__name__, self.herm_symbol, self.sch_symbol, self.spgid)
1001 return "%s, %s (%d)" % (self.herm_symbol, self.sch_symbol, self.spgid)
1006 return herm2sch(self.herm_symbol)
1267 def herm_symbol(self): member in BilbaoPointGroup
1456 def herm2sch(herm_symbol): argument
1458 return _HERM2SCH.get(herm_symbol, None)
|
| H A D | site_symmetries.py | 61 herm_symbol, ptg_num = "1", 1
63 herm_symbol, ptg_num, trans_mat = spglib.get_pointgroup(rotations)
65 … self.sitesym_labels.append("%s (#%d,nsym:%d)" % (herm_symbol.strip(), ptg_num, len(rotations)))
|
| H A D | structure.py | 1038 herm_symbol, ptg_num = "1", 1
1040 herm_symbol, ptg_num, trans_mat = spglib.get_pointgroup(rotations)
1042 … sitesym_labels.append("%s (#%d,nsym:%d)" % (herm_symbol.strip(), ptg_num, len(rotations)))
|