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Searched defs:ecutwfc (Results 1 – 13 of 13) sorted by relevance

/dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/
H A Dwrite_io_header.f9010 nr1, nr2, nr3, nat, ntyp, ibrav, celldm, at, gcutm, dual, ecutwfc, & argument
23 REAL(DP) :: celldm (6), gcutm, dual, ecutwfc, at(3,3) local
/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/
H A Dgvecw.f9027 REAL(DP) :: ecutwfc = 0.0_DP variable
H A Dqexsd_copy.f90269 SUBROUTINE qexsd_copy_basis_set ( basis_set, gamma_only, ecutwfc, ecutrho, & argument
282 REAL(dp), INTENT(out) :: ecutwfc, ecutrho, b1(:), b2(:), b3(:) local
H A Dqexsd_input.f90177 SUBROUTINE qexsd_init_basis(obj,k_points,ecutwfc,ecutrho,nr,nrs,nrb) argument
184 REAL(DP),INTENT(IN) :: ecutwfc local
H A Dinput_parameters.f90329 REAL(DP) :: ecutwfc = 0.0_DP variable
627 ntyp, nbnd, ecutwfc, ecutrho, nr1, nr2, nr3, nr1s, nr2s, & local
H A Dqes_init_module.f901548 …SUBROUTINE qes_init_basis(obj, tagname, ecutwfc, gamma_only, ecutrho, fft_grid, fft_smooth, fft_bo… argument
1555 REAL(DP),INTENT(IN) :: ecutwfc local
1600 SUBROUTINE qes_init_basis_set(obj, tagname, ecutwfc, fft_grid, ngm, npwx, reciprocal_lattice,& argument
1608 REAL(DP),INTENT(IN) :: ecutwfc local
H A Dqes_types_module.f90609 REAL(DP) :: ecutwfc component
1123 REAL(DP) :: ecutwfc component
H A Dqexsd_init.f90331 SUBROUTINE qexsd_init_basis_set(obj, gamma_only, ecutwfc, ecutrho, & argument
345 REAL(DP), INTENT(IN) :: ecutwfc, ecutrho local
/dports/science/berkeleygw/BGW-2.0.0/Common/
H A Dwfn_rho_vxc_io_inc.f9053 nat, nk, nbands, ngkmax, ecutrho, ecutwfc, FFTgrid, kgrid, kshift, celvol, & argument
62 real(DP), intent(INTENT) :: ecutrho, ecutwfc !< charge-density and wave-function cutoffs, in Ry local
660 nat, nk, nbands, ngkmax, ecutrho, ecutwfc, FFTgrid, kgrid, kshift, celvol, alat, avec, adot, & argument
668 real(DP), intent(INTENT) :: ecutrho, ecutwfc !< charge-density and wave-function cutoffs, in Ry local
H A Dtypedefs.f9048 real(DP) :: ecutwfc !< wave-function cutoff, in Ry component
/dports/science/quantum-espresso/q-e-qe-6.7.0/upflib/
H A Dpseudo_types.f9061 REAL(DP) :: ecutwfc ! suggested cut-off for wfc component
/dports/science/quantum-espresso/q-e-qe-6.7.0/atomic/src/
H A Dld1inc.f9097 ecutwfc, & ! suggested cut-off for the wavefunctions variable
/dports/science/quantum-espresso/q-e-qe-6.7.0/FFTXlib/
H A Dfft_test.f90120 REAL*8 :: ecutwfc variable