Searched refs:residual_vects (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_tddfpt2_eigensolver.F | 522 SUBROUTINE tddfpt_compute_residual_vects(residual_vects, evals, ritz_vects, Aop_ritz, gs_mos, & argument
524 TYPE(cp_fm_p_type), DIMENSION(:, :), INTENT(in) :: residual_vects local
547 nspins = SIZE(residual_vects, 1)
548 nrvs = SIZE(residual_vects, 2)
601 vomat(ispin)%matrix, 0.0_dp, residual_vects(ispin, irv)%matrix)
777 …CALL tddfpt_compute_residual_vects(residual_vects=krylov_vects(:, nvects_exist + 1:nvects_exist + …
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_tddfpt2_methods.F | 2506 SUBROUTINE tddfpt_compute_residual_vects(residual_vects, evals, ritz_vects, Aop_ritz, gs_mos, & argument
2508 TYPE(cp_fm_p_type), DIMENSION(:, :), INTENT(in) :: residual_vects local
2530 nspins = SIZE(residual_vects, 1)
2531 nrvs = SIZE(residual_vects, 2)
2572 … work_fm_mo_virt_mo_occ(ispin)%matrix, 0.0_dp, residual_vects(ispin, irv)%matrix)
2735 …CALL tddfpt_compute_residual_vects(residual_vects=krylov_vects(:, nvects_exist + 1:nvects_exist + …
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