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Searched refs:kg_tnadd_embed_ri (Results 1 – 14 of 14) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_update_s_mstruct.F20 kg_tnadd_embed_ri
220 qs_env%kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dqs_energy_init.F23 kg_tnadd_embed_ri,&
203 CASE (kg_tnadd_embed_ri)
H A Dkg_environment.F32 kg_tnadd_embed_ri,&
162 CASE (kg_tnadd_embed, kg_tnadd_embed_ri)
175 IF (kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dkg_correction.F21 kg_tnadd_embed_ri,&
122 ELSE IF (kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dinput_constants.F1034 kg_tnadd_embed_ri = 101, & variable
H A Dqs_environment.F99 do_qmmm_swave, general_roks, kg_tnadd_embed_ri, rel_none, rel_trans_atom, &
778 IF (tnadd_method == kg_tnadd_embed_ri) lribas = .TRUE.
H A Dinput_cp2k_dft.F68 kg_tnadd_embed, kg_tnadd_embed_ri, kg_tnadd_none, ls_2pnt, ls_3pnt, ls_gold, ls_none, &
5407 … enum_i_vals=(/kg_tnadd_embed, kg_tnadd_embed_ri, kg_tnadd_atomic, kg_tnadd_none/))
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_update_s_mstruct.F20 kg_tnadd_embed_ri
220 qs_env%kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dqs_energy_init.F23 kg_tnadd_embed_ri,&
203 CASE (kg_tnadd_embed_ri)
H A Dkg_environment.F38 kg_tnadd_embed_ri,&
292 CASE (kg_tnadd_embed, kg_tnadd_embed_ri)
305 IF (kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dkg_correction.F21 kg_tnadd_embed_ri,&
96 ELSE IF (kg_env%tnadd_method == kg_tnadd_embed_ri) THEN
H A Dinput_constants.F1019 kg_tnadd_embed_ri = 101, & variable
H A Dqs_environment.F96 do_qmmm_swave, general_roks, kg_tnadd_embed_ri, rel_none, rel_trans_atom, &
758 IF (tnadd_method == kg_tnadd_embed_ri) lribas = .TRUE.
H A Dinput_cp2k_dft.F67 kg_tnadd_embed_ri, kg_tnadd_none, ls_2pnt, ls_3pnt, ls_gold, ls_none, mao_basis_ext, &
5207 … enum_i_vals=(/kg_tnadd_embed, kg_tnadd_embed_ri, kg_tnadd_atomic, kg_tnadd_none/))