Searched refs:l0_ikind (Results 1 – 8 of 8) sorted by relevance
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_rho0_ggrid.F | 181 CALL get_rho0_mpole(rho0_mpole=rho0, ikind=ikind, l0_ikind=l0_ikind) 182 lmax_global = MAX(lmax_global, l0_ikind) 191 CALL get_rho0_mpole(rho0_mpole=rho0, ikind=ikind, l0_ikind=l0_ikind, & 194 nch_ik = ncoset(l0_ikind) 230 l0_ikind, zet0, 0, 0, 0.0_dp, 0, & 543 l0_ikind=l0_ikind, Qlm_gg=Qlm_gg, & 556 nch_ik = ncoset(l0_ikind) 586 l0_ikind, zet0, 0, 0, 0.0_dp, 0, & 597 DO lshell = 0, l0_ikind 686 DO iso = 1, nsoset(l0_ikind) [all …]
|
H A D | qs_rho0_types.F | 444 SUBROUTINE get_rho0_mpole(rho0_mpole, g0_h, vg0_h, iat, ikind, lmax_0, l0_ikind, & argument 453 INTEGER, INTENT(OUT), OPTIONAL :: lmax_0, l0_ikind local 479 IF (PRESENT(l0_ikind)) l0_ikind = rho0_mpole%lmax0_kind(ikind)
|
H A D | qs_rho0_methods.F | 219 l0_ikind=lmax0, mp_gau_ikind=mpole_gau, & 576 CALL get_rho0_mpole(rho0_mpole, ikind=ik, l0_ikind=lmax, &
|
H A D | hartree_local_methods.F | 354 l0_ikind=lmax0, &
|
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_rho0_ggrid.F | 102 ikind, ithread, j, l0_ikind, lmax0, & local 185 CALL get_rho0_mpole(rho0_mpole=rho0, ikind=ikind, l0_ikind=l0_ikind, & 188 nch_ik = ncoset(l0_ikind) 224 l0_ikind, zet0, 0, 0, 0.0_dp, 0, & 531 l0_ikind=l0_ikind, Qlm_gg=Qlm_gg, & 544 nch_ik = ncoset(l0_ikind) 574 l0_ikind, zet0, 0, 0, 0.0_dp, 0, & 584 DO lshell = 0, l0_ikind 637 DO iso = 1, MIN(nsoset(l0_ikind), max_iso_not0_local) 673 DO iso = 1, nsoset(l0_ikind) [all …]
|
H A D | qs_rho0_types.F | 444 SUBROUTINE get_rho0_mpole(rho0_mpole, g0_h, vg0_h, iat, ikind, lmax_0, l0_ikind, & argument 453 INTEGER, INTENT(OUT), OPTIONAL :: lmax_0, l0_ikind local 479 IF (PRESENT(l0_ikind)) l0_ikind = rho0_mpole%lmax0_kind(ikind)
|
H A D | qs_rho0_methods.F | 212 l0_ikind=lmax0, mp_gau_ikind=mpole_gau, & 557 CALL get_rho0_mpole(rho0_mpole, ikind=ik, l0_ikind=lmax, &
|
H A D | hartree_local_methods.F | 342 l0_ikind=lmax0, &
|