/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/HamiltonianOperations/ |
H A D | THCOpsIO.hpp | 58 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in loadTHCOps() typedef 158 shmCMatrix H1({NMO, NMO}, shared_allocator<ComplexType>{TGwfn.Node()}); in loadTHCOps() 159 shmCMatrix vn0({NMO, NMO}, shared_allocator<ComplexType>{TGwfn.Node()}); in loadTHCOps() 267 shmCMatrix hij({ndet, (NAEA + NAEB) * NMO}, shared_allocator<ComplexType>{TGwfn.Node()}); in loadTHCOps() 286 template<class shmVMatrix, class shmCMatrix> 297 shmCMatrix& H1, in writeTHCOps() 302 shmCMatrix& vn0, in writeTHCOps()
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H A D | Real3IndexFactorization.hpp | 80 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; typedef in qmcplusplus::afqmc::Real3IndexFactorization 97 shmCMatrix&& haj_, in Real3IndexFactorization() 101 shmCMatrix&& vn0_, in Real3IndexFactorization() 631 shmCMatrix haj; 645 shmCMatrix vn0;
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H A D | KPTHCOps.hpp | 58 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; typedef in qmcplusplus::afqmc::KPTHCOps 84 shmCMatrix&& haj_, in KPTHCOps() 86 shmCMatrix&& rotpiu_, in KPTHCOps() 90 std::vector<shmCMatrix>&& pau_, in KPTHCOps() 995 shmCMatrix haj;
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H A D | KP3IndexFactorizationIO.hpp | 46 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in loadKP3IndexFactorization() typedef 302 shmCMatrix haj({ndet * nkpts, (type == COLLINEAR ? 2 : 1) * nocc_max * nmo_max}, in loadKP3IndexFactorization()
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H A D | Real3IndexFactorization_batched.hpp | 65 using shmCMatrix = ComplexMatrix<Allocator_shared>; typedef in qmcplusplus::afqmc::Real3IndexFactorization_batched 572 shmCMatrix haj;
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H A D | Real3IndexFactorization_batched_v2.hpp | 85 using shmCMatrix = ComplexMatrix<Allocator_shared>; typedef in qmcplusplus::afqmc::Real3IndexFactorization_batched_v2 873 shmCMatrix hij_dev; 876 shmCMatrix haj;
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H A D | KP3IndexFactorization.hpp | 61 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; typedef in qmcplusplus::afqmc::KP3IndexFactorization 83 shmCMatrix&& h1, in KP3IndexFactorization() 1599 shmCMatrix haj; in getOneBodyPropagatorMatrix()
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H A D | KP3IndexFactorization_batched.hpp | 102 using shmCMatrix = ComplexMatrix<Allocator_shared>; typedef in qmcplusplus::afqmc::KP3IndexFactorization_batched 1505 shmCMatrix haj; in getOneBodyPropagatorMatrix()
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/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Wavefunctions/ |
H A D | PHMSD.hpp | 83 using shmCMatrix = boost::multi::array<ComplexType, 2, Allocator_shared>; typedef in qmcplusplus::afqmc::PHMSD 596 shmCMatrix unique_overlaps; 597 shmCMatrix unique_Etot; 598 shmCMatrix QQ0inv0; // Q * inv(Q0) 599 shmCMatrix QQ0inv1; // Q * inv(Q0) 600 shmCMatrix GA2D0_shm; 601 shmCMatrix GB2D0_shm;
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H A D | PHMSD.icc | 604 …shmCMatrix unique_overlaps_({2, maxn_unique_confg}, shared_allocator<ComplexType>{local_group_comm… 608 … shmCMatrix QQ0inv0_({OrbMats[0].size(0), NAEA}, shared_allocator<ComplexType>{local_group_comm}); 612 …shmCMatrix QQ0inv1_({OrbMats.back().size(0), NAEB}, shared_allocator<ComplexType>{local_group_comm… 616 …shmCMatrix GA2D0_shm_({GAdims0.first, GAdims0.second}, shared_allocator<ComplexType>{local_group_c… 620 …shmCMatrix GB2D0_shm_({GBdims0.first, GBdims0.second}, shared_allocator<ComplexType>{local_group_c… 987 shmCMatrix _ov_({2,maxn_unique_confg}, 1067 …shmCMatrix unique_overlaps_({2, maxn_unique_confg}, shared_allocator<ComplexType>{local_group_comm… 1071 … shmCMatrix QQ0inv0_({OrbMats[0].size(0), NAEA}, shared_allocator<ComplexType>{local_group_comm}); 1075 …shmCMatrix QQ0inv1_({OrbMats.back().size(0), NAEB}, shared_allocator<ComplexType>{local_group_comm… 1080 …shmCMatrix GA2D0_shm_({GAdims0.first, GAdims0.second}, shared_allocator<ComplexType>{local_group_c… [all …]
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H A D | NOMSD.hpp | 77 using shmCMatrix = boost::multi::array<ComplexType, 2, Allocator_shared>; typedef in qmcplusplus::afqmc::NOMSD
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/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Hamiltonians/ |
H A D | RealDenseHamiltonian_v2.cpp | 45 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations() typedef 199 shmCMatrix vn0({NMO, NMO}, shared_allocator<ComplexType>{distNode}); in getHamiltonianOperations() 200 shmCMatrix haj({ndet, NEL * NMO}, shared_allocator<ComplexType>{TG.Node()}); in getHamiltonianOperations()
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H A D | THCHamiltonian.cpp | 121 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations() typedef 197 shmCMatrix v0({NMO, NMO}, shared_allocator<ComplexType>{TG.Node()}); in getHamiltonianOperations() 365 shmCMatrix hij({ndet, (naea_ + naeb_) * NMO}, shared_allocator<ComplexType>{TG.Node()}); in getHamiltonianOperations() 366 shmCMatrix H1_({NMO, NMO}, shared_allocator<ComplexType>{TG.Node()}); in getHamiltonianOperations()
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H A D | RealDenseHamiltonian.cpp | 47 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations() typedef 200 shmCMatrix vn0({NMO, NMO}, shared_allocator<ComplexType>{distNode}); in getHamiltonianOperations() 201 shmCMatrix haj({ndet, NEL * NMO}, shared_allocator<ComplexType>{TG.Node()}); in getHamiltonianOperations()
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H A D | KPFactorizedHamiltonian.cpp | 59 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations_shared() typedef 341 shmCMatrix haj({ndet * nkpts, (type == COLLINEAR ? 2 : 1) * nocc_max * npol * nmo_max}, in getHamiltonianOperations_shared() 786 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations_batched() typedef 1087 shmCMatrix haj({ndet * nkpts, (type == COLLINEAR ? 2 : 1) * nocc_max * npol * nmo_max}, in getHamiltonianOperations_batched()
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H A D | KPTHCHamiltonian.cpp | 43 using shmCMatrix = boost::multi::array<ComplexType, 2, shared_allocator<ComplexType>>; in getHamiltonianOperations() typedef 411 shmCMatrix haj({ndet * nkpts, (type == COLLINEAR ? 2 : 1) * nocc_max * nmo_max}, in getHamiltonianOperations()
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/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Wavefunctions/tests/ |
H A D | test_wfn_factory.cpp | 906 using shmCMatrix = boost::multi::array<ComplexType,2alloc_, 928 shmCMatrix Gph({2*NMO*NMO,nwalk},alloc_); 929 shmCMatrix Gno({2*NMO*NMO,nwalk},alloc_); 943 shmCMatrix G({Gdim1,Gdim2},alloc_); 948 shmCMatrix X({nCV,nwalk},alloc_); 982 shmCMatrix vHS({vdim1,vdim2},alloc_); 1042 shmCMatrix G_({Gdim1_,Gdim2_},alloc_); 1058 shmCMatrix vHS_({vdim1_,vdim2_},alloc_);
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