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Searched refs:orb_vec_perm (Results 1 – 2 of 2) sorted by relevance

/dports/science/ergo/ergo-3.8/source/scf/
H A DSCF_unrestricted.cc1580 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
1581 eigVecOCC_alpha[orb].fullvector(orb_vec_perm); in create_gabedit_file()
1586 orb_vec[matOpts.inversePermutationHML[ind]] = orb_vec_perm[ind]; in create_gabedit_file()
1598 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
1599 eigVecUNOCC_alpha[orb].fullvector(orb_vec_perm); in create_gabedit_file()
1604 orb_vec[matOpts.inversePermutationHML[ind]] = orb_vec_perm[ind]; in create_gabedit_file()
1623 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
1624 eigVecOCC_beta[orb].fullvector(orb_vec_perm); in create_gabedit_file()
1629 orb_vec[matOpts.inversePermutationHML[ind]] = orb_vec_perm[ind]; in create_gabedit_file()
1641 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
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H A DSCF_restricted.cc1528 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
1529 eigVecOCC[orb].fullvector(orb_vec_perm); in create_gabedit_file()
1534 orb_vec[matOpts.inversePermutationHML[ind]] = orb_vec_perm[ind]; in create_gabedit_file()
1547 std::vector<ergo_real> orb_vec_perm(n); in create_gabedit_file() local
1548 eigVecUNOCC[orb].fullvector(orb_vec_perm); in create_gabedit_file()
1553 orb_vec[matOpts.inversePermutationHML[ind]] = orb_vec_perm[ind]; in create_gabedit_file()