Searched refs:ddb_header_keys (Results 1 – 2 of 2) sorted by relevance
| /dports/science/py-abipy/abipy-0.9.0/abipy/dfpt/tests/ |
| H A D | test_ddb.py | 510 ddb_header_keys = ["nkpt", "tsmear"]
511 r = robot.anacompare_elastic(ddb_header_keys=ddb_header_keys, with_path=True,
516 for k in ddb_header_keys:
527 … rinf = robot.anacompare_epsinf(ddb_header_keys="nkpt", chneut=0, with_path=True, verbose=2)
533 …r0 = robot.anacompare_eps0(ddb_header_keys=["nkpt", "tsmear"], asr=0, tol=1e-5, with_path=True, ve…
539 …rb = robot.anacompare_becs(ddb_header_keys=["nkpt", "tsmear"], chneut=0, tol=1e-5, with_path=True,…
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| /dports/science/py-abipy/abipy-0.9.0/abipy/dfpt/ |
| H A D | ddb.py | 2748 def anacompare_elastic(self, ddb_header_keys=None, with_structure=True, with_spglib=True, argument
2765 ddb_header_keys = [] if ddb_header_keys is None else list_strings(ddb_header_keys)
2777 for k in ddb_header_keys:
2794 def anacompare_becs(self, ddb_header_keys=None, chneut=1, tol=1e-3, with_path=False, verbose=0): argument
2812 ddb_header_keys = [] if ddb_header_keys is None else list_strings(ddb_header_keys)
2823 for k in ddb_header_keys:
2835 … def anacompare_epsinf(self, ddb_header_keys=None, chneut=1, tol=1e-3, with_path=False, verbose=0): argument
2853 ddb_header_keys = [] if ddb_header_keys is None else list_strings(ddb_header_keys)
2864 for k in ddb_header_keys:
2893 ddb_header_keys = [] if ddb_header_keys is None else list_strings(ddb_header_keys)
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