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Searched refs:rho_1c (Results 1 – 10 of 10) sorted by relevance

/dports/science/quantum-espresso/q-e-qe-6.7.0/TDDFPT/src/
H A Dlr_calc_dens.f9039 & n_ipol, becp1_virt, rho_1c,&
97 rho_1c(:,:) = (0.0d0, 0.0d0)
122 IF ( doublegrid ) CALL fft_interpolate(dffts, rho_1c(:,1), dfftp, rho_1c(:,1))
154 rho_1c(:,is) = rho_1c(:,is) + psic(:)
171 CALL mp_sum(rho_1c, inter_pool_comm)
618 rho_1c(ir,:) = rho_1c(ir,:) &
H A Dlr_dealloc.f9062 IF (allocated(rho_1c)) DEALLOCATE(rho_1c)
H A Dlr_alloc_init.f90165 ALLOCATE(rho_1c(dfftp%nnr,nspin_mag))
166 rho_1c(:,:)=(0.0d0,0.0d0)
H A Dlr_variables.f9092 rho_1c(:,:) ! response charge density in real space variable
H A Dlr_apply_liouvillian.f9041 USE lr_variables, ONLY : evc0, sevc0, revc0, rho_1, rho_1c, &
166 dvrsc(:,1) = rho_1c(:,1)
H A Dlr_dav_routines.f901858 use lr_variables, only : evc0, sevc0,R, nbnd_total,evc0_virt,rho_1,rho_1c
1899 rhoc(:)=rho_1c(:,1)
1905 rhoc(:)=rhoc(:)+rho_1c(:,1)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dlri_environment_methods.F856 lri_env%stat%rho_1c = 0.0_dp
949 lri_env%stat%rho_1c = lri_env%stat%rho_1c + str
1250 ppli_mem, ppx, rho_1c, rho_ff, rho_sr, rho_tt, rhos_mem local
1274 rho_1c = lri_env%stat%rho_1c
1276 rho_1c = 0.0_dp
1316 ppx = rho_1c/rho_tt*100._dp
1318 "[", ppx, "%]", rho_1c
H A Dlri_environment_types.F258 REAL(KIND=dp) :: rho_1c component
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dlri_environment_methods.F856 lri_env%stat%rho_1c = 0.0_dp
949 lri_env%stat%rho_1c = lri_env%stat%rho_1c + str
1250 ppli_mem, ppx, rho_1c, rho_ff, rho_sr, rho_tt, rhos_mem local
1274 rho_1c = lri_env%stat%rho_1c
1276 rho_1c = 0.0_dp
1316 ppx = rho_1c/rho_tt*100._dp
1318 "[", ppx, "%]", rho_1c
H A Dlri_environment_types.F258 REAL(KIND=dp) :: rho_1c component