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Searched refs:outer_scf_basis_center_opt (Results 1 – 8 of 8) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_outer_scf.F20 cdft2ot, do_ddapc_constraint, do_s2_constraint, ot2cdft, outer_scf_basis_center_opt, &
83 CASE (outer_scf_basis_center_opt)
162 CASE (outer_scf_basis_center_opt)
205 IF (scf_control%outer_scf%type == outer_scf_basis_center_opt) THEN
423 CASE (outer_scf_basis_center_opt)
491 CASE (outer_scf_basis_center_opt)
518 CASE (outer_scf_basis_center_opt)
H A Dscf_control_types.F24 outer_scf_basis_center_opt, outer_scf_cdft_constraint, outer_scf_ddapc_constraint, &
703 CASE (outer_scf_basis_center_opt)
H A Dinput_constants.F664 outer_scf_basis_center_opt = 127, & variable
H A Dinput_cp2k_dft.F77 outer_scf_basis_center_opt, outer_scf_becke_constraint, outer_scf_cdft_constraint, &
5510 … outer_scf_basis_center_opt, outer_scf_cdft_constraint, outer_scf_none/))
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_outer_scf.F20 cdft2ot, do_ddapc_constraint, do_s2_constraint, ot2cdft, outer_scf_basis_center_opt, &
83 CASE (outer_scf_basis_center_opt)
162 CASE (outer_scf_basis_center_opt)
205 IF (scf_control%outer_scf%type == outer_scf_basis_center_opt) THEN
423 CASE (outer_scf_basis_center_opt)
491 CASE (outer_scf_basis_center_opt)
518 CASE (outer_scf_basis_center_opt)
H A Dscf_control_types.F24 outer_scf_basis_center_opt, outer_scf_cdft_constraint, outer_scf_ddapc_constraint, &
703 CASE (outer_scf_basis_center_opt)
H A Dinput_constants.F661 outer_scf_basis_center_opt = 127, & variable
H A Dinput_cp2k_dft.F76 outer_scf_basis_center_opt, outer_scf_becke_constraint, outer_scf_cdft_constraint, &
5397 … outer_scf_basis_center_opt, outer_scf_cdft_constraint, outer_scf_none/))