File: apply_dpot.f90

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!
! Copyright (C) 2001-2018 Quantum ESPRESSO group
! This file is distributed under the terms of the
! GNU General Public License. See the file `License'
! in the root directory of the present distribution,
! or http://www.gnu.org/copyleft/gpl.txt .
!
SUBROUTINE apply_dpot(nrxxs, aux1, dv, current_spin)
  !
  !  This routine applies the change of the self consistent potential to
  !  one wavefunction
  !
  USE kinds,            ONLY : DP
  USE noncollin_module, ONLY : noncolin, npol, nspin_mag
  USE spin_orb,         ONLY : domag
  USE mp_bands,         ONLY : me_bgrp
  USE fft_base,         ONLY : dffts

  IMPLICIT NONE
  INTEGER, INTENT(IN) :: current_spin, nrxxs
  COMPLEX(DP), INTENT(IN) :: dv(nrxxs,nspin_mag)
  COMPLEX(DP), INTENT(INOUT) :: aux1(nrxxs,npol)

  COMPLEX(DP) :: sup, sdwn
  INTEGER :: ir

  IF (noncolin) THEN
     !
     IF ( dffts%has_task_groups ) THEN
        !
        ! Noncollinear part with task groups
        !
        IF (domag) THEN
           DO ir=1, dffts%nr1x*dffts%nr2x*dffts%my_nr3p
              sup = aux1(ir,1) * (dv(ir,1)+dv(ir,4)) + &
                    aux1(ir,2) * (dv(ir,2)-(0.d0,1.d0)*dv(ir,3))
              sdwn = aux1(ir,2) * (dv(ir,1)-dv(ir,4)) + &
                     aux1(ir,1) * (dv(ir,2)+(0.d0,1.d0)*dv(ir,3))
              aux1(ir,1)=sup
              aux1(ir,2)=sdwn
           ENDDO
        ELSE
           DO ir=1, dffts%nr1x*dffts%nr2x*dffts%my_nr3p
              aux1(ir,:) = aux1(ir,:) * dv(ir,1)
           ENDDO
        ENDIF
        !
     ELSE
        !
        ! Noncollinear part without task groups
        !
        IF (domag) then
           DO ir = 1, nrxxs
              sup=aux1(ir,1)*(dv(ir,1)+dv(ir,4))+ &
                  aux1(ir,2)*(dv(ir,2)-(0.d0,1.d0)*dv(ir,3))
              sdwn=aux1(ir,2)*(dv(ir,1)-dv(ir,4)) + &
                   aux1(ir,1)*(dv(ir,2)+(0.d0,1.d0)*dv(ir,3))
              aux1(ir,1)=sup
              aux1(ir,2)=sdwn
           ENDDO
        ELSE
           DO ir = 1, nrxxs
              aux1(ir,:)=aux1(ir,:)*dv(ir,1)
           ENDDO
        ENDIF
        !
     ENDIF
     !
  ELSE
     !
     IF ( dffts%has_task_groups ) THEN
        !
        ! Collinear part with task groups
        !
        DO ir = 1, dffts%nr1x*dffts%nr2x*dffts%my_nr3p
           aux1 (ir,1) = aux1 (ir,1) * dv(ir,1)
        ENDDO
        !
     ELSE
        !
        ! Collinear part without task groups
        !
        DO ir = 1, nrxxs
           aux1(ir,1)=aux1(ir,1)*dv(ir,current_spin)
        ENDDO
        !
     ENDIF
     !
  ENDIF
  !
  RETURN
  !
END SUBROUTINE apply_dpot