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Searched refs:with_geo (Results 1 – 16 of 16) sorted by relevance

/dports/science/py-abipy/abipy-0.9.0/abipy/dfpt/
H A Danaddbnc.py328 …def get_elastic_dataframe(self, with_geo=True, abspath=False, with_params=False, funcs=None, **kwa… argument
357 if with_geo:
381 df = self.get_elastic_dataframe(with_geo=False, abspath=False, with_params=False)
H A Dddb.py2651 with_geo=True, with_spglib=True, abspath=False, funcs=None): argument
2699 if with_geo:
/dports/science/py-abipy/abipy-0.9.0/abipy/panels/
H A Dgsr.py56 df = self.robot.get_dataframe(with_geo=True)
/dports/science/py-abipy/abipy-0.9.0/abipy/electrons/tests/
H A Dtest_bse.py114 df = robot.get_dataframe(with_geo=True)
H A Dtest_gw.py260 qpdata = robot.get_qpgaps_dataframe(with_geo=True)
/dports/science/py-abipy/abipy-0.9.0/abipy/eph/tests/
H A Dtest_a2f.py108 data = robot.get_dataframe(with_geo=True)
/dports/science/py-abipy/abipy-0.9.0/abipy/electrons/
H A Dgsr.py404 def get_dataframe(self, with_geo=True, abspath=False, funcs=None, **kwargs): argument
435 if with_geo:
H A Dbse.py937 def get_dataframe(self, with_geo=False, abspath=False, funcs=None, **kwargs): argument
965 if with_geo:
H A Dgw.py1827 …def get_qpgaps_dataframe(self, spin=None, kpoint=None, with_geo=False, abspath=False, funcs=None, … argument
1865 if with_geo:
H A Debands.py787 def get_dict4pandas(self, with_geo=True, with_spglib=True): argument
810 if with_geo:
/dports/science/py-abipy/abipy-0.9.0/abipy/wannier90/
H A Dabiwan.py532 def get_dataframe(self, with_geo=True, abspath=False, funcs=None, **kwargs): argument
563 if with_geo:
/dports/science/py-abipy/abipy-0.9.0/abipy/abio/tests/
H A Dtest_outputs.py200 df = robot.get_dataframe(with_geo=True)
/dports/science/py-abipy/abipy-0.9.0/abipy/dfpt/tests/
H A Dtest_ddb.py372 data = robot.get_dataframe_at_qpoint(qpoint=(0, 0, 0), units="meV", with_geo=False)
487 dipdip=0, with_geo=True, abspath=True)
/dports/science/py-abipy/abipy-0.9.0/abipy/dynamics/
H A Dhist.py562 …def get_dataframe(self, with_geo=True, index=None, abspath=False, with_spglib=True, funcs=None, **… argument
598 if with_geo:
/dports/science/py-abipy/abipy-0.9.0/abipy/abio/
H A Doutputs.py925 def get_dataframe(self, with_geo=True, with_dims=True, abspath=False, funcs=None): argument
949 if with_geo and abo.run_completed:
/dports/science/py-abipy/abipy-0.9.0/abipy/eph/
H A Da2f.py970 def get_dataframe(self, abspath=False, with_geo=False, with_params=True, funcs=None): argument
1001 if with_geo: