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Searched refs:do_s2_constraint (Results 1 – 10 of 10) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Ds_square_methods.F28 USE input_constants, ONLY: do_s2_constraint,&
184 CASE (do_s2_constraint)
H A Dqs_outer_scf.F20 cdft2ot, do_ddapc_constraint, do_s2_constraint, ot2cdft, outer_scf_basis_center_opt, &
148 is_constraint = (s2_restraint_control%functional_form == do_s2_constraint)
H A Dinput_constants.F697 do_s2_constraint = 873 variable
H A Dcp_control_utils.F36 do_pwgrid_ns_halfspace, do_pwgrid_spherical, do_s2_constraint, do_s2_restraint, &
1784 CASE (do_s2_constraint)
H A Dinput_cp2k_dft.F59 do_pwgrid_ns_halfspace, do_pwgrid_spherical, do_s2_constraint, do_s2_restraint, &
4791 enum_i_vals=(/do_s2_restraint, do_s2_constraint/), &
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Ds_square_methods.F28 USE input_constants, ONLY: do_s2_constraint,&
184 CASE (do_s2_constraint)
H A Dqs_outer_scf.F20 cdft2ot, do_ddapc_constraint, do_s2_constraint, ot2cdft, outer_scf_basis_center_opt, &
148 is_constraint = (s2_restraint_control%functional_form == do_s2_constraint)
H A Dinput_constants.F694 do_s2_constraint = 873 variable
H A Dcp_control_utils.F36 do_pwgrid_ns_halfspace, do_pwgrid_spherical, do_s2_constraint, do_s2_restraint, &
1741 CASE (do_s2_constraint)
H A Dinput_cp2k_dft.F57 do_pwgrid_ns_halfspace, do_pwgrid_spherical, do_s2_constraint, do_s2_restraint, &
4591 enum_i_vals=(/do_s2_restraint, do_s2_constraint/), &