/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
H A D | fft_rho.f90 | 28 SUBROUTINE rho_r2g ( desc, rhor, rhog, v ) argument 34 COMPLEX(dp), INTENT(OUT):: rhog(:,:) local 97 SUBROUTINE rho_g2r_1 ( desc, rhog, rhor ) argument 102 COMPLEX(dp), INTENT(in ):: rhog(:) local 121 SUBROUTINE rho_g2r_2 ( desc, rhog, rhor ) argument 126 COMPLEX(dp), INTENT(in ):: rhog(:,:) local 179 SUBROUTINE rho_g2r_sum_components ( desc, rhog, rhor ) argument 184 COMPLEX(dp), INTENT(in ):: rhog(:,:) local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/ |
H A D | plugin_utilities.f90 | 2 SUBROUTINE v_h_of_rho_g( rhog, ehart, charge, v ) argument 32 COMPLEX(DP), INTENT(IN) :: rhog(dfftp%ngm, nspin) local 126 COMPLEX(DP), ALLOCATABLE :: rhog(:,:) local 149 SUBROUTINE force_h_of_rho_g( rhog, ei1, ei2, ei3, omega, fion ) argument 181 COMPLEX(DP), INTENT(IN) :: rhog(dfftp%ngm) local 274 COMPLEX(DP), ALLOCATABLE :: rhog(:) local
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H A D | exch_corr.f90 | 12 subroutine exch_corr_h( nspin, rhog, rhor, rhoc, sfac, exc, dxc, self_exc ) argument 44 complex(DP) :: rhog( dfftp%ngm, nspin ) local 259 subroutine gradh( nspin, gradr, rhog, rhor, dexc ) argument 278 complex(DP) :: rhog( dfftp%ngm, nspin ) local
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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 83 COMPLEX(DP) rhog( :, : ) local 491 SUBROUTINE drhov(irb,eigrb,rhovan,drhovan,rhog,rhor,drhog,drhor) argument 523 COMPLEX(DP), INTENT(IN) :: eigrb(ngb,nat), rhog(dfftp%ngm,nspin) local 764 SUBROUTINE rhov(irb,eigrb,rhovan,rhog,rhor) argument 797 COMPLEX(DP), INTENT(inout):: rhog(dfftp%ngm,nspin) local
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H A D | wannier.f90 | 339 SUBROUTINE ef_tune( rhog, tau0 ) argument 347 COMPLEX(DP) :: rhog(:,:) local 365 SUBROUTINE write_charge_and_exit( rhog ) argument 372 COMPLEX(DP) :: rhog(:,:) local 390 taub, irb, ibrav, b1, b2, b3, rhor, drhor, rhog, & argument 413 COMPLEX(DP) :: rhog(:,:) local
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H A D | nlcc.f90 | 91 subroutine add_cc( rhoc, rhog, rhor ) argument 115 COMPLEX(DP), INTENT(INOUT):: rhog( dfftp%ngm, nspin ) local
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H A D | inner_loop_cold.f90 | 11 rhor, rhog, rhos, rhoc, ei1, ei2, ei3, & argument 73 COMPLEX(kind=DP) :: rhog( dfftp%ngm, nspin ) local 311 rhor, rhog, rhos, rhoc, ei1, ei2, ei3, & argument 364 COMPLEX(kind=DP) :: rhog( dfftp%ngm, nspin ) local
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H A D | vofrho.f90 | 9 SUBROUTINE vofrho_x( nfi, rhor, drhor, rhog, drhog, rhos, rhoc, tfirst, & argument 76 COMPLEX(DP) :: rhog(:,:), drhog(:,:,:,:) local
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H A D | ksstates.f90 | 154 COMPLEX(DP), ALLOCATABLE :: psi(:), rhog(:,:) local
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H A D | cg_sub.f90 | 12 rhor, rhog, rhos, rhoc, ei1, ei2, ei3, sfac, fion, ema0bg, becdr, & argument 78 complex(dp) :: rhog(dfftp%ngm,nspin) local
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H A D | potentials.f90 | 235 COMPLEX(DP) :: rhet, rhog, rp, vscreen local 345 COMPLEX(DP) :: cxc, rhet, rhog, vp, rp, gxc, gyc, gzc local 592 COMPLEX(DP) :: rhog local
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/dports/science/siesta/siesta-4.1.5/Src/ |
H A D | rhofft.F | 20 subroutine rhofft( CELL, N1, N2, N3, Mesh, nspin, RHO, rhog, argument
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/dports/science/qbox/qbox-public-rel1_73_3/src/ |
H A D | ChargeDensity.h | 54 std::vector<std::vector<std::complex<double> > > rhog; // rhog[ispin][ig] variable
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/ |
H A D | pawplot.f90 | 204 COMPLEX(dp), ALLOCATABLE :: rhog(:) variable 347 SUBROUTINE plot_1d_ (nx, x0, e, rhog, rhoplot, flag, filplot ) argument 365 COMPLEX(DP), INTENT(in) :: rhog (ngm) local
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H A D | chdens_module.f90 | 98 COMPLEX(DP), ALLOCATABLE:: rhog (:) local 596 SUBROUTINE plot_1d (nx, m1, x0, e, ngm, g, rhog, alat, iflag, ounit) argument 619 COMPLEX(DP) :: rhog (ngm) local 724 SUBROUTINE plot_2d (nx, ny, m1, m2, x0, e1, e2, ngm, g, rhog, alat, & argument 751 COMPLEX(DP) :: rhog (ngm) local 868 SUBROUTINE plot_2ds (nx, ny, x0, ngm, g, rhog, output_format, ounit) argument 887 COMPLEX(DP) :: rhog (ngm) local 978 SUBROUTINE plot_3d (alat, at, nat, tau, atm, ityp, ngm, g, rhog, & argument 1008 COMPLEX(DP) :: rhog (ngm) local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/LR_Modules/ |
H A D | Coul_cut_2D_ph.f90 | 190 subroutine cutoff_dynmat0 (dynwrk, rhog) argument 206 COMPLEX(DP), INTENT(IN) :: rhog ( dfftp%nnr) local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
H A D | stres_gradcorr.f90 | 10 SUBROUTINE stres_gradcorr( rho, rhog, rho_core, rhog_core, kedtau, nspin, & argument 31 COMPLEX(DP), INTENT(IN) :: rhog(dfft%ngm, nspin) local
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H A D | gradcorr.f90 | 10 SUBROUTINE gradcorr( rho, rhog, rho_core, rhog_core, etxc, vtxc, v ) argument 29 COMPLEX(DP), INTENT(IN) :: rhog(ngm,nspin), rhog_core(ngm) local
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H A D | Coul_cut_2D.f90 | 169 SUBROUTINE cutoff_hartree( rhog, aux1, ehart ) argument 181 COMPLEX(DP), INTENT(IN) :: rhog(ngm) local
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H A D | esm.f90 | 95 COMPLEX(DP) :: rhog(ngm) local 314 COMPLEX(DP), INTENT(IN) :: rhog(ngm) local 614 COMPLEX(DP) :: rhog(ngm) local 642 COMPLEX(DP) :: rhog(ngm) local 877 COMPLEX(DP) :: rhog(ngm) local 1129 COMPLEX(DP) :: rhog(ngm) local 1365 COMPLEX(DP) :: rhog(ngm) local 5115 COMPLEX(DP) :: rhog(ngm) local 5391 COMPLEX(DP) :: rhog(ngm) local 5694 COMPLEX(DP) :: rhog(ngm) local [all …]
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H A D | v_of_rho.f90 | 505 SUBROUTINE v_h( rhog, ehart, charge, v ) argument 525 COMPLEX(DP), INTENT(IN) :: rhog(ngm) local 1364 COMPLEX( DP ), ALLOCATABLE :: rhog( : ) local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PHonon/PH/ |
H A D | dynmat_us.f90 | 67 COMPLEX(DP), ALLOCATABLE :: rhog (:), aux1 (:,:), work1 (:), & local
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/lib/exchange-correlation/ |
H A D | v_bwexc.F | 36 integer agr(3),fn(2),fdn(3),tmp(2),rhog(2) local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/pw/ |
H A D | pw_poisson_methods.F | 265 TYPE(pw_type), POINTER :: rhog, rhor, tmpg, vhartree_rs local
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/dports/science/cp2k-data/cp2k-7.1.0/src/pw/ |
H A D | pw_poisson_methods.F | 265 TYPE(pw_type), POINTER :: rhog, rhor, tmpg, vhartree_rs local
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