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/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Propagators/
H A DPropagatorFactory.cpp70 CVector vMF(iextensions<1u>{wfn.local_number_of_cholesky_vectors()}, allocator{}); in buildAFQMCPropagator() local
72 fill_n(vMF.origin(), vMF.num_elements(), ComplexType(0)); in buildAFQMCPropagator()
75 wfn.vMF(vMF); in buildAFQMCPropagator()
80 fill_n(vMF.origin(), vMF.num_elements(), ComplexType(0)); in buildAFQMCPropagator()
81 TG.TG().all_reduce_in_place_n(to_address(vMF.origin()), vMF.num_elements(), std::plus<>()); in buildAFQMCPropagator()
85 boost::multi::array<ComplexType, 1> vMF_(vMF.extensions()); in buildAFQMCPropagator()
87 copy_n(vMF.origin(), vMF.num_elements(), vMF_.origin()); in buildAFQMCPropagator()
103 … return Propagator(AFQMCBasePropagator(AFinfo, cur, TG, wfn, std::move(H1), std::move(vMF), rng)); in buildAFQMCPropagator()
109 …agator(AFQMCDistributedPropagatorDistCV(AFinfo, cur, TG, wfn, std::move(H1), std::move(vMF), rng)); in buildAFQMCPropagator()
111 …n Propagator(AFQMCDistributedPropagator(AFinfo, cur, TG, wfn, std::move(H1), std::move(vMF), rng)); in buildAFQMCPropagator()
H A DAFQMCBasePropagator.icc705 // X[m,ni,iw] = rand[m,ni,iw] + im * ( vbias[m,iw] - vMF[m] )
706 // HW[ni,iw] = sum_m [ im * ( vMF[m] - vbias[m,iw] ) *
707 // ( rand[m,ni,iw] + halfim * ( vbias[m,iw] - vMF[m] ) ) ]
708 // = sum_m [ im * ( vMF[m] - vbias[m,iw] ) *
709 // ( X[m,ni,iw] - halfim * ( vbias[m,iw] - vMF[m] ) ) ]
710 // MF[ni,iw] = sum_m ( im * X[m,ni,iw] * vMF[m] )
731 …kernels::construct_X(nCV, nsteps, nwalk, free_projection, sqrtdt, vbias_bound, to_address(vMF.orig…
743 auto vmf_t = sqrtdt * apply_bound_vbias(vMF[m], 1.0);
744 auto vmf_ = sqrtdt * vMF[m];
H A DAFQMCBasePropagator.h102 vMF(std::move(vmf_)),
191 CVector vMF; variable
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Numerics/detail/CUDA/Kernels/
H A Dconstruct_X.cu39 thrust::complex<T> const* vMF, in kernel_construct_X() argument
54 thrust::complex<T> const* vmf_(vMF); in kernel_construct_X()
104 thrust::complex<T> const* vMF, in kernel_construct_X_free_projection() argument
116 thrust::complex<T> const* vmf_(vMF); in kernel_construct_X_free_projection()
145 std::complex<double> const* vMF, in construct_X() argument
160 … reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
174 std::complex<double> const* vMF, in construct_X() argument
189 … reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
203 std::complex<double> const* vMF, in construct_X() argument
218 … reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
[all …]
H A Dconstruct_X.cuh29 std::complex<double> const* vMF,
40 std::complex<double> const* vMF,
51 std::complex<double> const* vMF,
62 std::complex<double> const* vMF,
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Numerics/detail/HIP/Kernels/
H A Dconstruct_X.hip.cpp35 thrust::complex<T> const* vMF, in kernel_construct_X() argument
50 thrust::complex<T> const* vmf_(vMF); in kernel_construct_X()
112 thrust::complex<T> const* vmf_(vMF); in kernel_construct_X_free_projection()
141 std::complex<double> const* vMF, in construct_X() argument
155 reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
168 std::complex<double> const* vMF, in construct_X() argument
182 reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
195 std::complex<double> const* vMF, in construct_X() argument
209 reinterpret_cast<thrust::complex<double> const*>(vMF), in construct_X()
222 std::complex<double> const* vMF, in construct_X() argument
[all …]
H A Dconstruct_X.hip.h26 std::complex<double> const* vMF,
37 std::complex<double> const* vMF,
48 std::complex<double> const* vMF,
59 std::complex<double> const* vMF,
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Wavefunctions/
H A DWavefunction.hpp99 void vMF(Vec&& v) in vMF() function in qmcplusplus::afqmc::dummy::dummy_wavefunction
277 void vMF(Args&&... args) in vMF() function in qmcplusplus::afqmc::Wavefunction
279 boost::apply_visitor([&](auto&& a) { a.vMF(std::forward<Args>(args)...); }, *this); in vMF()
H A DPHMSD.hpp243 void vMF(Vec&& v);
H A DNOMSD.hpp233 void vMF(Vec&& v);
H A DPHMSD.icc1249 void PHMSD::vMF(Vec&& v)
1391 // NOTE: since SpvnT is a truncated structure the complex part of vMF,
H A DNOMSD.icc2191 void NOMSD<devPsiT>::vMF(Vec&& v)
2325 // NOTE: since SpvnT is a truncated structure the complex part of vMF,
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Wavefunctions/tests/
H A Dtest_wfn_factory.cpp1026 boost::multi::array<ComplexType,1> vMF(iextensions<1u>{nCV});
1027 wfn.vMF(vMF);
1031 for(int i=0; i<vMF.size(0); i++)
1032 vMFsum += vMF[i];
1089 nomsd.vMF(vMF2);
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/HamiltonianOperations/
H A DSparseTensor.hpp133 CMatrix getOneBodyPropagatorMatrix(TaskGroup_& TG, CVector const& vMF) in getOneBodyPropagatorMatrix() argument
143 vHS(vMF, H1D); in getOneBodyPropagatorMatrix()
H A DReal3IndexFactorization_batched.hpp124 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
130 CVector vMF_(vMF); in getOneBodyPropagatorMatrix()
H A DReal3IndexFactorization.hpp130 CMatrix getOneBodyPropagatorMatrix(TaskGroup_& TG, boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
140 vHS(vMF, H1D); in getOneBodyPropagatorMatrix()
H A DKPTHCOps.hpp202 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
211 set_shm_buffer(vMF.size(0)); in getOneBodyPropagatorMatrix()
212 boost::multi::array_ref<ComplexType, 1> vMF_(to_address(SM_TMats.origin()), {vMF.size(0)}); in getOneBodyPropagatorMatrix()
H A DReal3IndexFactorization_batched_v2.hpp153 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
159 CVector vMF_(vMF); in getOneBodyPropagatorMatrix()
H A DKP3IndexFactorization.hpp179 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
186 shmCVector vMF_(iextensions<1u>{vMF.num_elements()}, shared_allocator<ComplexType>{*comm}); in getOneBodyPropagatorMatrix()
191 copy_n(vMF.origin(), vMF.num_elements(), vMF_.origin()); in getOneBodyPropagatorMatrix()
H A DTHCOps.hpp185 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
193 …ShmArray<ComplexType, 1> vMF_(vMF, shm_buffer_manager.get_generator().template get_allocator<Compl… in getOneBodyPropagatorMatrix()
H A DKP3IndexFactorization_batched.hpp338 … boost::multi::array<ComplexType, 1> const& vMF) in getOneBodyPropagatorMatrix() argument
344 CVector vMF_(vMF); in getOneBodyPropagatorMatrix()
/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Propagators/store/
H A DAFQMCDistributedPropagatorDistCV.icc122 // right hand side matrix in calculation of HS potential for all steps: ~ sigma + (vbias-vMF)
/dports/math/py-heyoka/heyoka.py-0.16.0/doc/notebooks/
H A DThe two-fixed elliptic billiard.ipynb304 …ofEXJxcNKy5MxYhjWcQkJ0MiqNEu8AV+LC7c/huGfJrJ60h9UT9+DorCVvcT+qNCxNg87V8M//7vMF/nfLNP/nghGNxv6wOLzt…
/dports/math/py-seriate/seriate-1.1.2/doc/
H A Dimage_example.ipynb147 …jSTcMQxa6\nE3Na8301Dy/Q8G6k/7o6BWcMi7W5L30EjRr4oB/8xxtsJzv4jz8oUG7wX+RgO5E+vMF/keeD+hj4\nmv4WnmfQK…
/dports/graphics/vigra/vigra-8acd73a/vigranumpy/examples/
H A DVigraGraphs.ipynb61 …ee6uDmZPktU8drCuNSO7QpeuEZvi1133i/FVRM0a2u8qWf9gCrGUdJIKZ7juPCT\n37ujjL/H8+vMF+8SYypoTewGz7YTOl9JN…

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