/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qmmm_gpw_forces.F | 399 aug_pools, auxbas_grid, coarser_grid, cube_info, para_env, & argument 405 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 610 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 796 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1209 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1512 eps_mm_rspace, aug_pools, debug_force, & argument 1521 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1630 SUBROUTINE debug_qmmm_forces_with_gauss_LG(pgfs, aug_pools, rho, mm_charges, mm_atom_index, & argument 1635 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1746 SUBROUTINE debug_qmmm_forces_with_gauss_LR(pgfs, aug_pools, rho, mm_charges, mm_atom_index, & argument [all …]
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H A D | qmmm_gpw_energy.F | 245 aug_pools, cube_info, para_env, eps_mm_rspace, pw_pools, & argument 250 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local
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H A D | qmmm_types_low.F | 227 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools component
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qmmm_gpw_forces.F | 399 aug_pools, auxbas_grid, coarser_grid, cube_info, para_env, & argument 405 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 596 aug_pools, mm_cell, dOmmOqm, periodic, per_potentials, iw, par_scheme,& argument 610 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 785 aug_pools, mm_cell, dOmmOqm, iw, par_scheme, qmmm_spherical_cutoff, shells) argument 796 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1199 aug_pools, mm_cell, dOmmOqm, iw, par_scheme, qmmm_spherical_cutoff, shells) argument 1210 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1522 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local 1636 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local [all …]
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H A D | qmmm_gpw_energy.F | 245 aug_pools, cube_info, para_env, eps_mm_rspace, pw_pools, & argument 250 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools local
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H A D | qmmm_types_low.F | 227 TYPE(pw_pool_p_type), DIMENSION(:), POINTER :: aug_pools component
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