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Searched refs:dvxc_s (Results 1 – 13 of 13) sorted by relevance

/dports/science/quantum-espresso/q-e-qe-6.7.0/LR_Modules/
H A Dsetup_dgc.f9030 dvxc_ss, dvxc_s, vsgga, segni
62 IF (.NOT.ALLOCATED(dvxc_s) ) ALLOCATE( dvxc_s(dfftp%nnr,nspin_gga,nspin_gga) )
75 dvxc_s(:,:,:) = 0.d0
134 dvxc_s(:,1,1) = e2 * (v2x(:,1) + v2c(:,1))
144 dvxc_s(k,1,1) = e2 * (v2x(k,1) + v2c(k,1))
145 dvxc_s(k,1,2) = e2 * v2c(k,1)
146 dvxc_s(k,2,1) = e2 * v2c(k,1)
147 dvxc_s(k,2,2) = e2 * (v2x(k,2) + v2c(k,1))
H A Ddgradcorr.f9010 dvxc_s, xq, drho, nspin, nspin0, g, dvxc) argument
33 dvxc_ss (dfft%nnr,nspin0, nspin0), dvxc_s (dfft%nnr, nspin0, nspin0) local
123 dvxc_s (k, 1, 1) * gdrho (ipol, k, 1)
179 dvxc_s (k, is, js) * gdrho(ipol, k, js)
H A Ddv_of_drho.f9036 USE gc_lr, ONLY : grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
100 dvxc_sr, dvxc_ss, dvxc_s, xq, dvscf, &
H A Dlrcom.f90121 dvxc_s(:,:,:) variable
/dports/science/quantum-espresso/q-e-qe-6.7.0/HP/src/
H A Dhp_dealloc_q.f9022 & dvxc_s, vsgga, segni
63 if (allocated(dvxc_s)) deallocate (dvxc_s)
/dports/science/quantum-espresso/q-e-qe-6.7.0/PHonon/PH/
H A Ddeallocate_phq.f9035 USE gc_lr, ONLY : grho, gmag, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s, &
151 if(allocated(dvxc_s)) deallocate (dvxc_s)
H A Daddnlcc_zstar_eu_us.f9028 USE gc_lr, ONLY: grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
78 dvxc_sr, dvxc_ss, dvxc_s, xq, drhoscf(1,1,ipol), &
H A Daddnlcc.f9031 USE gc_lr, ONLY: grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
97 dvxc_sr, dvxc_ss, dvxc_s, xq, drhoscf(1, 1, ipert), &
H A Ddvqpsi_us.f9042 USE gc_lr, ONLY: grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
182 dvxc_sr, dvxc_ss, dvxc_s, xq, drhoc, nspin, nspin_gga, g, aux)
/dports/science/quantum-espresso/q-e-qe-6.7.0/PHonon/Gamma/
H A Ddgradcorr.f9027 dvxc_ss (dfft%nnr,nspin, nspin), dvxc_s (dfft%nnr, nspin, nspin) local
66 dvxc_s (k, 1, 1) * gdrho (ipol, k, 1)
122 dvxc_s (k, is, js) * gdrho(ipol, k, js)
H A Dcg_setup.f9031 USE gc_lr, ONLY: grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
64 ALLOCATE ( dvxc_s (dfftp%nnr,nspin,nspin))
H A Da_h.f9024 USE gc_lr, ONLY: grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
127 (dfftp, rho%of_r, grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s, &
/dports/science/quantum-espresso/q-e-qe-6.7.0/EPW/src/
H A Ddvqpsi.f9058 USE gc_lr, ONLY : grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s
211 CALL dgradcorr(dfftp, rho%of_r, grho, dvxc_rr, dvxc_sr, dvxc_ss, dvxc_s, xq0, drhoc, &