/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | semi_empirical_int_debug.F | 149 SUBROUTINE rot_2el_2c_first_debug(sepi, sepj, rijv, se_int_control, se_taper, invert, ii, kk, v_d) argument 165 REAL(KIND=dp), DIMENSION(3), INTENT(IN) :: rijv local 402 SUBROUTINE check_drotnuc_ana(sepi, sepj, rijv, itype, se_int_control, se_taper, e1b, e2a, de1b, de2… argument 413 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 507 SUBROUTINE check_dcorecore_ana(sepi, sepj, rijv, itype, se_int_control, se_taper, enuc, denuc) argument 518 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 641 SUBROUTINE check_rotint_ana(sepi, sepj, rijv, w, dw, se_int_control, se_taper) argument 652 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_num.F | 75 SUBROUTINE rotint_num(sepi, sepj, rijv, w, se_int_control, se_taper) argument 77 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 400 SUBROUTINE rotnuc_num(sepi, sepj, rijv, e1b, e2a, itype, se_int_control, se_taper) argument 402 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 508 SUBROUTINE corecore_num(sepi, sepj, rijv, enuc, itype, se_int_control, se_taper) argument 510 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 684 SUBROUTINE corecore_el_num(sepi, sepj, rijv, enuc, itype, se_int_control, se_taper) argument 686 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_ana.F | 87 RECURSIVE SUBROUTINE rotnuc_ana(sepi, sepj, rijv, itype, e1b, e2a, de1b, de2a, & argument 90 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 347 RECURSIVE SUBROUTINE corecore_ana(sepi, sepj, rijv, itype, enuc, denuc, se_int_control, se_taper) argument 349 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 657 RECURSIVE SUBROUTINE corecore_el_ana(sepi, sepj, rijv, itype, enuc, denuc, & argument 660 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 1249 RECURSIVE SUBROUTINE rotint_ana(sepi, sepj, rijv, w, dw, se_int_control, se_taper) argument 1251 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_utils.F | 2073 RECURSIVE SUBROUTINE rot_2el_2c_first(sepi, sepj, rijv, se_int_control, se_taper, & argument 2076 REAL(KIND=dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_gks.F | 487 SUBROUTINE corecore_gks(sepi, sepj, rijv, enuc, denuc, se_int_control) argument 489 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | semi_empirical_int_debug.F | 149 SUBROUTINE rot_2el_2c_first_debug(sepi, sepj, rijv, se_int_control, se_taper, invert, ii, kk, v_d) argument 165 REAL(KIND=dp), DIMENSION(3), INTENT(IN) :: rijv local 402 SUBROUTINE check_drotnuc_ana(sepi, sepj, rijv, itype, se_int_control, se_taper, e1b, e2a, de1b, de2… argument 413 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 507 SUBROUTINE check_dcorecore_ana(sepi, sepj, rijv, itype, se_int_control, se_taper, enuc, denuc) argument 518 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 641 SUBROUTINE check_rotint_ana(sepi, sepj, rijv, w, dw, se_int_control, se_taper) argument 652 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_num.F | 75 SUBROUTINE rotint_num(sepi, sepj, rijv, w, se_int_control, se_taper) argument 77 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 400 SUBROUTINE rotnuc_num(sepi, sepj, rijv, e1b, e2a, itype, se_int_control, se_taper) argument 402 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 508 SUBROUTINE corecore_num(sepi, sepj, rijv, enuc, itype, se_int_control, se_taper) argument 510 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 684 SUBROUTINE corecore_el_num(sepi, sepj, rijv, enuc, itype, se_int_control, se_taper) argument 686 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_ana.F | 87 RECURSIVE SUBROUTINE rotnuc_ana(sepi, sepj, rijv, itype, e1b, e2a, de1b, de2a, & argument 90 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 347 RECURSIVE SUBROUTINE corecore_ana(sepi, sepj, rijv, itype, enuc, denuc, se_int_control, se_taper) argument 349 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 657 RECURSIVE SUBROUTINE corecore_el_ana(sepi, sepj, rijv, itype, enuc, denuc, & argument 660 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local 1249 RECURSIVE SUBROUTINE rotint_ana(sepi, sepj, rijv, w, dw, se_int_control, se_taper) argument 1251 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_utils.F | 2073 RECURSIVE SUBROUTINE rot_2el_2c_first(sepi, sepj, rijv, se_int_control, se_taper, & argument 2076 REAL(KIND=dp), DIMENSION(3), INTENT(IN) :: rijv local
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H A D | semi_empirical_int_gks.F | 487 SUBROUTINE corecore_gks(sepi, sepj, rijv, enuc, denuc, se_int_control) argument 489 REAL(dp), DIMENSION(3), INTENT(IN) :: rijv local
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