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QuAcK/src/CC/form_X.f90

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subroutine form_X(nC,nO,nV,nR,OOVV,t2,X1,X2,X3,X4)
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! Form intermediate arrays X's in CCD
implicit none
! Input variables
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integer,intent(in) :: nC,nO,nV,nR
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double precision,intent(in) :: t2(nO,nO,nV,nV)
double precision,intent(in) :: OOVV(nO,nO,nV,nV)
! Local variables
integer :: i,j,k,l
integer :: a,b,c,d
! Output variables
double precision,intent(out) :: X1(nO,nO,nO,nO)
double precision,intent(out) :: X2(nV,nV)
double precision,intent(out) :: X3(nO,nO)
double precision,intent(out) :: X4(nO,nO,nV,nV)
! Initialization
X1(:,:,:,:) = 0d0
X2(:,:) = 0d0
X3(:,:) = 0d0
X4(:,:,:,:) = 0d0
! Build X1
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do k=nC+1,nO
do l=nC+1,nO
do i=nC+1,nO
do j=nC+1,nO
do c=1,nV-nR
do d=1,nV-nR
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X1(k,l,i,j) = X1(k,l,i,j) + OOVV(k,l,c,d)*t2(i,j,c,d)
enddo
enddo
enddo
enddo
enddo
enddo
! Build X2
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do b=1,nV-nR
do c=1,nV-nR
do k=nC+1,nO
do l=nC+1,nO
do d=1,nV-nR
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X2(b,c) = X2(b,c) + OOVV(k,l,c,d)*t2(k,l,b,d)
enddo
enddo
enddo
enddo
enddo
! Build X3
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do k=nC+1,nO
do j=nC+1,nO
do l=nC+1,nO
do c=1,nV-nR
do d=1,nV-nR
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X3(k,j) = X3(k,j) + OOVV(k,l,c,d)*t2(j,l,c,d)
enddo
enddo
enddo
enddo
enddo
! Build X4
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do i=nC+1,nO
do l=nC+1,nO
do a=1,nV-nR
do d=1,nV-nR
do k=nC+1,nO
do c=1,nV-nR
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X4(i,l,a,d) = X4(i,l,a,d) + OOVV(k,l,c,d)*t2(i,k,a,c)
enddo
enddo
enddo
enddo
enddo
enddo
end subroutine form_X