Searched refs:loop_ao2mo (Results 1 – 2 of 2) sorted by relevance
| /dports/science/py-pyscf/pyscf-2.0.1/pyscf/mp/ |
| H A D | dfmp2.py | 55 for istep, qov in enumerate(mp.loop_ao2mo(mo_coeff, nocc)):
90 def loop_ao2mo(self, mo_coeff, nocc): member in DFMP2
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| H A D | dfgmp2.py | 60 for qova, qovb in mp.loop_ao2mo(mo_coeff, nocc, orbspin):
87 def loop_ao2mo(self, mo_coeff, nocc, orbspin): member in DFGMP2
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