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Searched refs:shm_atomic_pair_list (Results 1 – 8 of 8) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmp2_direct_method.F144 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
222 shm_atomic_pair_list => actual_x_data%atomic_pair_list
238 shm_atomic_pair_list)
245 shm_atomic_pair_list)
H A Dhfx_derivatives.F161 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
834 shm_atomic_pair_list => actual_x_data%atomic_pair_list_forces
836 … CALL build_atomic_pair_list(natom, shm_atomic_pair_list, kind_of, basis_parameter, particle_set, &
942 log10_eps_schwarz, cell, pmax_blocks, shm_atomic_pair_list)
948 log10_eps_schwarz, cell, pmax_blocks, shm_atomic_pair_list)
H A Dmp2_ri_libint.F452 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
721 shm_atomic_pair_list => actual_x_data%atomic_pair_list
737 shm_atomic_pair_list)
H A Dhfx_energy_potential.F192 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
1063 shm_atomic_pair_list => actual_x_data%atomic_pair_list
1065 … CALL build_atomic_pair_list(natom, shm_atomic_pair_list, kind_of, basis_parameter, particle_set, &
1168 shm_atomic_pair_list)
1175 shm_atomic_pair_list)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmp2_direct_method.F144 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
222 shm_atomic_pair_list => actual_x_data%atomic_pair_list
238 shm_atomic_pair_list)
245 shm_atomic_pair_list)
H A Dhfx_derivatives.F157 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
828 shm_atomic_pair_list => actual_x_data%atomic_pair_list_forces
830 … CALL build_atomic_pair_list(natom, shm_atomic_pair_list, kind_of, basis_parameter, particle_set, &
936 log10_eps_schwarz, cell, pmax_blocks, shm_atomic_pair_list)
942 log10_eps_schwarz, cell, pmax_blocks, shm_atomic_pair_list)
H A Dmp2_ri_libint.F452 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
721 shm_atomic_pair_list => actual_x_data%atomic_pair_list
737 shm_atomic_pair_list)
H A Dhfx_energy_potential.F192 LOGICAL, DIMENSION(:, :), POINTER :: shm_atomic_pair_list local
1063 shm_atomic_pair_list => actual_x_data%atomic_pair_list
1065 … CALL build_atomic_pair_list(natom, shm_atomic_pair_list, kind_of, basis_parameter, particle_set, &
1168 shm_atomic_pair_list)
1175 shm_atomic_pair_list)