Searched refs:tot1_h (Results 1 – 4 of 4) sorted by relevance
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_scf_output.F | 302 tot1_h, tot1_s local
325 tot1_h = qs_charges%total_rho1_hard(1)
328 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
333 tot1_h, tot1_s
336 accurate_sum(tot_rho_r) + tot1_h - tot1_s, &
338 accurate_sum(tot_rho_r) + tot1_h - tot1_s &
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| H A D | qs_ks_utils.F | 836 REAL(dp) :: tot1_h, tot1_s, tot_rho_r, trace, & local
891 tot1_h = qs_charges%total_rho1_hard(1)
894 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
900 tot1_h, tot1_s
903 tot_rho_r + tot1_h - tot1_s, &
905 tot_rho_r + tot1_h - tot1_s &
910 qs_charges%background = tot_rho_r + tot1_h - tot1_s + &
913 tot1_h = qs_charges%total_rho1_hard(1)
916 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
922 tot1_h, tot1_s
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_scf_output.F | 303 implicit_ps_ehartree, tot1_h, tot1_s local
334 tot1_h = qs_charges%total_rho1_hard(1)
337 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
342 tot1_h, tot1_s
345 accurate_sum(tot_rho_r) + tot1_h - tot1_s, &
347 accurate_sum(tot_rho_r) + tot1_h - tot1_s &
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| H A D | qs_ks_utils.F | 838 REAL(dp) :: tot1_h, tot1_s, tot_rho_r, trace, & local
893 tot1_h = qs_charges%total_rho1_hard(1)
896 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
902 tot1_h, tot1_s
905 tot_rho_r + tot1_h - tot1_s, &
907 tot_rho_r + tot1_h - tot1_s &
912 qs_charges%background = tot_rho_r + tot1_h - tot1_s + &
915 tot1_h = qs_charges%total_rho1_hard(1)
918 tot1_h = tot1_h + qs_charges%total_rho1_hard(ispin)
924 tot1_h, tot1_s
[all …]
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