Searched refs:OrbMat (Results 1 – 4 of 4) sorted by relevance
| /dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Utilities/ |
| H A D | readWfn.cpp | 151 OrbMat[i][j] = dummy; in read_mat()
169 OrbMat[i][j] = dummy; in read_mat()
362 …csr::shm::construct_csr_matrix_single_input<PsiT_Matrix>(OrbMat(OrbMat.extension(0), {0, NAEB}), 1… in read_general_wavefunction()
398 read_mat(in, OrbMat(OrbMat.extension(0), {0, NAEB}), Cstyle, fullMOMat, NMO, NAEB); in read_general_wavefunction()
400 …csr::shm::construct_csr_matrix_single_input<PsiT_Matrix>(OrbMat(OrbMat.extension(0), {0, NAEB}), 1… in read_general_wavefunction()
531 read_mat(in, OrbMat, Cstyle, fullMOMat, nmo_, nmo_); in read_ph_wavefunction()
537 read_mat(in, OrbMat, Cstyle, fullMOMat, NMO, NMO); in read_ph_wavefunction()
1031 OrbMat.reextent({1, NMO, NAEA}); in readWfn()
1032 read_mat(in, OrbMat[0], Cstyle, fullMOMat, NMO, NAEA); in readWfn()
1036 OrbMat.reextent({2, NMO, NAEA}); in readWfn()
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| H A D | readWfn.h | 81 boost::multi::array<ComplexType, 3>& OrbMat,
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| /dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/HamiltonianOperations/tests/ |
| H A D | test_hamiltonian_operations.cpp | 138 boost::multi::array<ComplexType, 3> OrbMat({2, NPOL * NMO, NAEA}); in ham_ops_basic_serial() local
146 OrbMat[0][i][j] = Psi0A[i][j]; in ham_ops_basic_serial()
157 OrbMat[1][i][j] = Psi0B[i][j]; in ham_ops_basic_serial()
174 boost::multi::array<ComplexType, 3, Alloc> devOrbMat(OrbMat, alloc_); in ham_ops_basic_serial()
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| /dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Wavefunctions/ |
| H A D | PHMSD.icc | 419 …// if not compact, calculate compact on temporary storage and multiply by OrbMat[] on the left at …
453 // always calculate compact and multiply by OrbMat at the end if full
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