Searched defs:lri_basis_init (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | lri_environment_init.F | 335 SUBROUTINE lri_basis_init(lri_env) subroutine
338 CHARACTER(len=*), PARAMETER :: routineN = 'lri_basis_init', routineP = moduleN//':'//routineN argument
340 INTEGER :: ikind, nkind
341 INTEGER, DIMENSION(:, :, :), POINTER :: orb_index, ri_index
342 REAL(KIND=dp) :: delta
343 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: dovlp3
344 REAL(KIND=dp), DIMENSION(:), POINTER :: orb_norm_r, ri_int_fbas, ri_norm_r, &
346 REAL(KIND=dp), DIMENSION(:, :), POINTER :: orb_ovlp, ri_ovlp, ri_ovlp_inv
347 REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: scon_orb, scon_ri
348 REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: scon_mix
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | lri_environment_init.F | 335 SUBROUTINE lri_basis_init(lri_env) subroutine
338 CHARACTER(len=*), PARAMETER :: routineN = 'lri_basis_init', routineP = moduleN//':'//routineN argument
340 INTEGER :: ikind, nkind
341 INTEGER, DIMENSION(:, :, :), POINTER :: orb_index, ri_index
342 REAL(KIND=dp) :: delta
343 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: dovlp3
344 REAL(KIND=dp), DIMENSION(:), POINTER :: orb_norm_r, ri_int_fbas, ri_norm_r, &
346 REAL(KIND=dp), DIMENSION(:, :), POINTER :: orb_ovlp, ri_ovlp, ri_ovlp_inv
347 REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: scon_orb, scon_ri
348 REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: scon_mix
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