| /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
34 REAL(DP), INTENT(OUT) :: ehart, charge local
93 SUBROUTINE v_h_of_rho_r( rhor, ehart, charge, v ) argument
120 REAL(DP), INTENT(OUT) :: ehart, charge local
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
| H A D | read_file_new.f90 | 166 REAL(DP) :: ehart, etxc, vtxc, etotefield, charge local
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| H A D | v_of_rho.f90 | 10 ehart, etxc, vtxc, eth, etotefield, charge, v ) argument
47 REAL(DP), INTENT(OUT) :: ehart local
505 SUBROUTINE v_h( rhog, ehart, charge, v ) argument
529 REAL(DP), INTENT(OUT) :: ehart local
1345 SUBROUTINE v_h_of_rho_r( rhor, ehart, charge, v ) argument
1360 REAL( DP ), INTENT(OUT) :: ehart, charge local
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| H A D | Coul_cut_2D.f90 | 169 SUBROUTINE cutoff_hartree( rhog, aux1, ehart ) argument
185 REAL(DP), INTENT(INOUT) :: ehart local
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| H A D | pwcom.f90 | 301 REAL(DP) :: ehart variable
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| H A D | esm.f90 | 83 SUBROUTINE esm_hartree( rhog, ehart, aux ) argument
93 REAL(DP) :: ehart local
603 SUBROUTINE esm_hartree_pbc( rhog, ehart, aux ) argument
612 REAL(DP) :: ehart local
625 SUBROUTINE esm_hartree_bc1( rhog, ehart, aux ) argument
640 REAL(DP) :: ehart local
860 SUBROUTINE esm_hartree_bc2( rhog, ehart, aux ) argument
875 REAL(DP) :: ehart local
1112 SUBROUTINE esm_hartree_bc3( rhog, ehart, aux ) argument
1127 REAL(DP) :: ehart local
[all …]
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/GWW/pw4gww/ |
| H A D | energies_xc.f90 | 99 REAL(kind=DP) :: ehart, charge local
227 REAL(kind=DP) :: etxc,vtxc,ehart, charge local
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| /dports/science/qbox/qbox-public-rel1_73_3/src/ |
| H A D | EnergyFunctional.h | 91 double ehart(void) const { return ehart_; } in ehart() function
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| H A D | BOSampleStepper.cpp | 773 double ehart, ehart_m; in step() local
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
| H A D | qexsd.f90 | 447 etot, eband, ehart, vtxc, etxc, ewald, degauss, demet, forces, & argument
459 …REAL(DP),INTENT(IN) :: tau(3,nat), alat, a1(3), a2(3), a3(3), etot, eband, ehart, vtxc… local
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| H A D | qexsd_init.f90 | 915 SUBROUTINE qexsd_init_total_energy(obj, etot, eband, ehart, vtxc, etxc, ewald, degauss, demet, & argument
923 REAL(DP),INTENT(IN) :: etot, ehart,vtxc,etxc local
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| H A D | qes_init_module.f90 | 2903 SUBROUTINE qes_init_total_energy(obj, tagname, etot, eband, ehart, vtxc, etxc, ewald, demet,& argument
2912 REAL(DP),OPTIONAL,INTENT(IN) :: ehart local
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| H A D | qes_types_module.f90 | 986 REAL(DP) :: ehart component
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/ |
| H A D | vasp_xml_module.f90 | 140 REAL(DP) :: rdum(1,1), ehart, etxc, vtxc, etotefield, charge local
|