| /dports/science/quantum-espresso/q-e-qe-6.7.0/GWW/simple_bse/ |
| H A D | hamiltonian.f90 | 14 INTEGER :: n!number of vectors
15 TYPE(bands), INTENT(in) :: bd
18 TYPE(prod_mix), INTENT(in) :: pm
19 TYPE(exc), INTENT(in) :: a(n)
23 INTEGER :: i,ik,jk,ii,jj,kk
24 COMPLEX(kind=DP), ALLOCATABLE :: emat(:,:),vemat(:,:)
25 COMPLEX(kind=DP), ALLOCATABLE :: hmat(:,:,:), imat(:,:,:)
26 COMPLEX(kind=DP), ALLOCATABLE :: bvc(:,:),bvc_t(:,:)
27 COMPLEX(kind=DP), ALLOCATABLE :: gcc_t(:,:,:),imat_t(:,:,:), gvv_t(:,:,:)
28 COMPLEX(kind=DP) :: fact
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| /dports/devel/boost-docs/boost_1_72_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() function
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/devel/boost-python-libs/boost_1_72_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() argument
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/databases/percona57-pam-for-mysql/boost_1_59_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() argument
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
|
| /dports/databases/mysqlwsrep57-server/boost_1_59_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() argument
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
|
| /dports/databases/percona57-server/boost_1_59_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() function
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/databases/xtrabackup/boost_1_59_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() function
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() function
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/databases/percona57-client/boost_1_59_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() function
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() function
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
|
| /dports/devel/boost-libs/boost_1_72_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() function
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() argument
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/devel/hyperscan/boost_1_75_0/libs/numeric/odeint/examples/mtl/ |
| H A D | gauss_packet.cpp | 34 struct hamiltonian { struct
39 hamiltonian( const int N ) : m_H( N , N ) in hamiltonian() argument
47 hamiltonian( mtl::compressed2D< double > &V ) : m_H( num_rows( V ) , num_cols( V ) ) in hamiltonian() function
54 void initialize_kinetic_term( ) in initialize_kinetic_term()
68 void operator()( const state_type &psi , state_type &dpsidt , const double t ) in operator ()()
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| /dports/math/stan/stan-2.28.2/src/test/unit/mcmc/hmc/integrators/ |
| H A D | impl_leapfrog_test.cpp | 79 hamiltonian(*model); in TEST_F() local
111 hamiltonian(*model); in TEST_F() local
145 hamiltonian(*model); in TEST_F() local
177 hamiltonian(*model); in TEST_F() local
211 hamiltonian(*model); in TEST_F() local
243 hamiltonian(*model); in TEST_F() local
277 hamiltonian(*model); in TEST_F() local
309 hamiltonian(*model); in TEST_F() local
341 hamiltonian(*model); in TEST_F() local
373 hamiltonian(*model); in TEST_F() local
[all …]
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| H A D | expl_leapfrog_test.cpp | 76 hamiltonian(*model); in TEST_F() local
108 hamiltonian(*model); in TEST_F() local
140 hamiltonian(*model); in TEST_F() local
172 hamiltonian(*model); in TEST_F() local
204 hamiltonian(*model); in TEST_F() local
236 hamiltonian(*model); in TEST_F() local
268 hamiltonian(*model); in TEST_F() local
300 hamiltonian(*model); in TEST_F() local
331 hamiltonian(*model); in TEST_F() local
363 hamiltonian(*model); in TEST_F() local
[all …]
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| /dports/science/berkeleygw/BGW-2.0.0/MeanField/EPM/ |
| H A D | hamiltonianMod.f90 | 61 Subroutine HInit(hamiltonian, maxHDim) argument
70 type( hamiltonianArrayT ), pointer :: hamiltonian local
132 Subroutine HDestroy( hamiltonian ) argument
137 type( hamiltonianArrayT ), pointer :: hamiltonian local
159 Subroutine HDiagonalize( hamiltonian, eigenStates, k ) argument
170 type( hamiltonianArrayT ), pointer :: hamiltonian local
242 Subroutine HPrint( hamiltonian ) argument
248 type( hamiltonianArrayT ), pointer :: hamiltonian local
267 Subroutine HCheck( hamiltonian, eigenStates, ik ) argument
276 type( hamiltonianArrayT ), pointer :: hamiltonian local
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| /dports/science/py-OpenFermion/OpenFermion-1.3.0/src/openfermion/circuits/trotter/ |
| H A D | diagonal_coulomb_trotter_error.py | 26 def diagonal_coulomb_potential_and_kinetic_terms_as_arrays(hamiltonian): argument
106 def split_operator_trotter_error_operator_diagonal_two_body(hamiltonian, order): argument
215 hamiltonian, external_potential_at_end=False): argument
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| H A D | low_depth_trotter_error.py | 143 hamiltonian, input_ordering=None, external_potential_at_end=False): argument
230 def stagger_with_info(hamiltonian, argument
338 def ordered_low_depth_terms_no_info(hamiltonian): argument
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| H A D | simulate_trotter_test.py | 142 def test_simulate_trotter_simulate(hamiltonian, time, initial_state, argument
189 def test_simulate_trotter_simulate_controlled(hamiltonian, time, initial_state, argument
345 def test_trotter_misspecified_control_raises_error(algorithm_type, hamiltonian): argument
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| /dports/science/py-OpenFermion/OpenFermion-1.3.0/src/openfermion/transforms/repconversions/ |
| H A D | fourier_transforms.py | 19 def _fourier_transform_helper(hamiltonian, grid, spinless, phase_factor, argument
53 def fourier_transform(hamiltonian, grid, spinless): argument
77 def inverse_fourier_transform(hamiltonian, grid, spinless): argument
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| /dports/math/stan/stan-2.28.2/src/stan/mcmc/hmc/integrators/ |
| H A D | impl_leapfrog.hpp | 19 Hamiltonian& hamiltonian, double epsilon, in begin_update_p()
25 void update_q(typename Hamiltonian::PointType& z, Hamiltonian& hamiltonian, in update_q()
44 Hamiltonian& hamiltonian, double epsilon, in end_update_p()
51 void hat_phi(typename Hamiltonian::PointType& z, Hamiltonian& hamiltonian, in hat_phi()
57 void hat_tau(typename Hamiltonian::PointType& z, Hamiltonian& hamiltonian, in hat_tau()
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| H A D | expl_leapfrog.hpp | 17 Hamiltonian& hamiltonian, double epsilon, in begin_update_p()
22 void update_q(typename Hamiltonian::PointType& z, Hamiltonian& hamiltonian, in update_q()
29 Hamiltonian& hamiltonian, double epsilon, in end_update_p()
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| H A D | base_leapfrog.hpp | 17 void evolve(typename Hamiltonian::PointType& z, Hamiltonian& hamiltonian, in evolve()
25 Hamiltonian& hamiltonian, const double epsilon, in verbose_evolve()
|
| /dports/math/py-pystan/pystan-2.19.0.0/pystan/stan/src/stan/mcmc/hmc/integrators/ |
| H A D | impl_leapfrog.hpp | 18 Hamiltonian& hamiltonian, in begin_update_p()
27 Hamiltonian& hamiltonian, in update_q()
47 Hamiltonian& hamiltonian, in end_update_p()
56 Hamiltonian& hamiltonian, in hat_phi()
64 Hamiltonian& hamiltonian, in hat_tau()
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| H A D | expl_leapfrog.hpp | 18 Hamiltonian& hamiltonian, double epsilon, in begin_update_p()
24 Hamiltonian& hamiltonian, double epsilon, in update_q()
31 Hamiltonian& hamiltonian, double epsilon, in end_update_p()
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| H A D | base_leapfrog.hpp | 19 Hamiltonian& hamiltonian, in evolve()
32 Hamiltonian& hamiltonian, in verbose_evolve()
|
| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/lcao/ |
| H A D | eigensolver.py | 32 def calculate_hamiltonian_matrix(self, hamiltonian, wfs, kpt, Vt_xMM=None, argument
85 def iterate(self, hamiltonian, wfs, occ=None): argument
100 def iterate_one_k_point(self, hamiltonian, wfs, kpt, Vt_xMM): argument
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| /dports/science/py-OpenFermion/OpenFermion-1.3.0/src/openfermion/circuits/ |
| H A D | trotter_exp_to_qgates.py | 67 def trotter_operator_grouping(hamiltonian, argument
279 def trotterize_exp_qubop_to_qasm(hamiltonian, argument
|