gridxc_xwpbe Module

\brief Calculates short range exchange part for wPBE functional and averaged PBE exchange-hole functional (omega = 0.0 ) \par History Manuel Guidon (05.2007) : initial version \author Manuel Guidon (05.2007)


Uses

    • gridxc_precision

Contents


Subroutines

public subroutine xwpbe(nspin, Dens, GDens, EX, DEXDD, DEXDGD)

Arguments

Type IntentOptional AttributesName
integer :: nspin
real(kind=dp) :: Dens(nspin)
real(kind=dp) :: GDens(3,nspin)
real(kind=dp) :: EX
real(kind=dp) :: DEXDD(nspin)
real(kind=dp) :: DEXDGD(3,nspin)