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| H A D | mainvar.f90 | 92 REAL(DP), ALLOCATABLE :: drhor(:,:,:,:) variable
191 ALLOCATE( drhor( nnr, nspin, 3, 3 ), STAT=ierr )
196 ALLOCATE( drhor( 1, 1, 1, 1 ) )
288 IF( ALLOCATED( drhor ) ) DEALLOCATE( drhor )
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| H A D | cg_sub.f90 | 56 USE cp_main_variables, ONLY : idesc, drhor, drhog
223 rhovan,rhor,drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6)
248 call vofrho(nfi,vpot,drhor,rhog,drhog,rhos,rhoc,tfirst,tlast, &
584 drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6)
595 call vofrho(nfi,vpot,drhor,rhog,drhog,rhos,rhoc,tfirst,tlast, &
648 drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6)
659 call vofrho(nfi,vpot,drhor,rhog,drhog,rhos,rhoc,tfirst,tlast, &
742 drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6)
753 call vofrho(nfi,vpot,drhor,rhog,drhog,rhos,rhoc,tfirst,tlast, &
823 drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6)
[all …]
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| H A D | chargedensity.f90 | 11 …( nfi, c_bgrp, irb, eigrb, bec_bgrp, dbec, rhovan, rhor, drhor, rhog, drhog, rhos, enl, denl, ekin… argument
78 REAL(DP) drhor(:,:,:,:) local
259 CALL drhov( irb, eigrb, rhovan, drhovan, rhog, rhor, drhog, drhor )
525 REAL(DP), INTENT(OUT) :: drhor(dfftp%nnr,nspin,3,3) local
561 drhor(ir,iss,i,j)=-rhor(ir,iss)*ainv(j,i)
673 drhor(ir,iss,i,j) = drhor(ir,iss,i,j) + DBLE(v(ir))
745 drhor(ir,isup,i,j) = drhor(ir,isup,i,j) + DBLE(v(ir))
746 drhor(ir,isdw,i,j) = drhor(ir,isdw,i,j) +AIMAG(v(ir))
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| H A D | move_electrons.f90 | 19 USE cp_main_variables, ONLY : eigr, irb, eigrb, rhog, rhos, rhor, drhor, &
84 drhor, rhog, drhog, rhos, enl, denl, ekin, dekin6 )
119 CALL vofrho( nfi, vpot, drhor, rhog, drhog, rhos, rhoc, tfirst, tlast,&
125 b2, b3, vpot, drhor, rhog, drhog, rhos, enl, ekin )
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| H A D | inner_loop_cold.f90 | 52 USE cp_main_variables, ONLY: idesc, drhor, drhog
121 rhor, drhor, rhog, drhog, rhos, enl, denl, ekin, dekin6 )
127 CALL vofrho( nfi, vpot, drhor, rhog, drhog, rhos, rhoc, tfirst, &
262 rhor, drhor, rhog, drhog, rhos, enl, denl, ekin, dekin6 )
268 CALL vofrho( nfi, vpot, drhor, rhog, drhog, rhos, rhoc, tfirst, &
343 USE cp_main_variables, ONLY: idesc, drhor, drhog
411 rhor, drhor, rhog, drhog, rhos, enl, denl, ekin, dekin6 )
417 CALL vofrho( nfi, vpot, drhor, rhog, drhog, rhos, rhoc, tfirst, &
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| H A D | fromscra.f90 | 57 vpot, ht0, edft, becdr_bgrp, dbec, drhor, drhog
195 …CALL rhoofr( nfi, cm_bgrp, irb, eigrb, bec_bgrp, dbec, becsum, rhor, drhor, rhog, drhog, rhos, enl…
215 CALL vofrho( nfi, vpot, drhor, rhog, drhog, rhos, rhoc, tfirst, tlast, &
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| H A D | wannier.f90 | 390 taub, irb, ibrav, b1, b2, b3, rhor, drhor, rhog, & argument
415 REAL(DP) :: drhor(:,:,:,:), rhor(:,:), rhos(:,:) local
428 …CALL rhoofr (nfi,cm, irb, eigrb,bec,dbec,rhovan,rhor,drhor,rhog,drhog,rhos,enl,denl,ekin,dekin6,.f…
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| H A D | vol_clu.f90 | 24 USE cp_main_variables, only: drhor
331 & v_vol(ir)*drhor(ir,is,k,j)*omega/ &
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| H A D | exch_corr.f90 | 33 use cp_main_variables, only : drhor
143 dxc(i,j) = dxc(i,j) + rhor( ir, iss ) * drhor( ir, iss, i, j )
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| H A D | cp_interfaces.f90 | 228 …( nfi, c_bgrp, irb, eigrb, bec, dbec, rhovan, rhor, drhor, rhog, drhog, rhos, enl, denl, ekin, dek…
239 REAL(DP) drhor(:,:,:,:) local
833 SUBROUTINE vofrho_x( nfi, rhor, drhor, rhog, drhog, rhos, rhoc, tfirst, tlast, &
839 REAL(DP) :: rhor(:,:), drhor(:,:,:,:), rhos(:,:), fion(:,:) local
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| H A D | vofrho.f90 | 71 REAL(DP) :: rhor(:,:), drhor(:,:,:,:), rhos(:,:), fion(:,:) local
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| H A D | cpr.f90 | 99 drhor, drhog, bec_bgrp, dbec
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