Searched defs:xc_contribution (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | rpa_rse.F | 510 …SUBROUTINE xc_contribution(qs_env, fm_XC_ao, fm_XC_ao_mo, fm_XC_mo, mo_coeff, dimen, fm_XC_mo_beta… subroutine
516 CHARACTER(LEN=*), PARAMETER :: routineN = 'xc_contribution', & argument
517 routineP = moduleN//':'//routineN
519 INTEGER :: handle, i local
520 LOGICAL :: alpha_beta
521 REAL(KIND=dp) :: exc
522 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: matrix_vxc
523 TYPE(pw_p_type), DIMENSION(:), POINTER :: tau_rspace, v_rspace
524 TYPE(qs_ks_env_type), POINTER :: ks_env
525 TYPE(qs_rho_type), POINTER :: rho
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | rpa_rse.F | 510 …SUBROUTINE xc_contribution(qs_env, fm_XC_ao, fm_XC_ao_mo, fm_XC_mo, mo_coeff, dimen, fm_XC_mo_beta… subroutine
516 CHARACTER(LEN=*), PARAMETER :: routineN = 'xc_contribution', & argument
517 routineP = moduleN//':'//routineN
519 INTEGER :: handle, i local
520 LOGICAL :: alpha_beta
521 REAL(KIND=dp) :: exc
522 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: matrix_vxc
523 TYPE(pw_p_type), DIMENSION(:), POINTER :: tau_rspace, v_rspace
524 TYPE(qs_ks_env_type), POINTER :: ks_env
525 TYPE(qs_rho_type), POINTER :: rho
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