Searched refs:a_hdab_sph (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_rho0_ggrid.F | 363 REAL(dp), DIMENSION(:, :, :), POINTER :: a_hdab_sph, hadb, hdab, Qlm_gg local
504 NULLIFY (hab, hab_sph, hdab, hdab_sph, hadb, pab, a_hdab, a_hdab_sph)
512 CALL reallocate(a_hdab_sph, 1, 3, 1, 3, 1, nch_max)
589 a_hdab_sph(1:3, 1:3, iso) = 0.0_dp
612 a_hdab_sph(i, ii, iso) = a_hdab_sph(i, ii, iso) + &
685 … virial%pv_virial(i, ii) = virial%pv_virial(i, ii) + Qlm(iso)*a_hdab_sph(i, ii, iso)
701 DEALLOCATE (hab, hdab, hadb, hab_sph, hdab_sph, pab, a_hdab, a_hdab_sph)
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_rho0_ggrid.F | 378 REAL(dp), DIMENSION(:, :, :), POINTER :: a_hdab_sph, hadb, hdab, Qlm_gg local
516 NULLIFY (hab, hab_sph, hdab, hdab_sph, hadb, pab, a_hdab, a_hdab_sph)
524 CALL reallocate(a_hdab_sph, 1, 3, 1, 3, 1, nch_max)
602 a_hdab_sph(1:3, 1:3, iso) = 0.0_dp
625 a_hdab_sph(i, ii, iso) = a_hdab_sph(i, ii, iso) + &
698 … virial%pv_virial(i, ii) = virial%pv_virial(i, ii) + Qlm(iso)*a_hdab_sph(i, ii, iso)
714 DEALLOCATE (hab, hdab, hadb, hab_sph, hdab_sph, pab, a_hdab, a_hdab_sph)
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