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quantum_package/plugins/dress_zmq/dressing_vector.irp.f

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BEGIN_PROVIDER [ double precision, dressing_column_h, (N_det,N_states) ]
&BEGIN_PROVIDER [ double precision, dressing_column_s, (N_det,N_states) ]
implicit none
BEGIN_DOC
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! \Delta_{state-specific}. \Psi
END_DOC
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integer :: i,ii,k,j, l
double precision :: f, tmp
double precision, external :: u_dot_v
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dressing_column_h(:,:) = 0.d0
dressing_column_s(:,:) = 0.d0
do k=1,N_states
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do j = 1, n_det
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dressing_column_h(j,k) = delta_ij(k,j,1)
dressing_column_s(j,k) = delta_ij(k,j,2)
enddo
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! tmp = u_dot_v(dressing_column_h(1,k), psi_coef(1,k), N_det) &
! - dressing_column_h(l,k) * psi_coef(l,k)
! dressing_column_h(l,k) -= tmp * f
! tmp = u_dot_v(dressing_column_s(1,k), psi_coef(1,k), N_det) &
! - dressing_column_s(l,k) * psi_coef(l,k)
! dressing_column_s(l,k) -= tmp * f
enddo
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END_PROVIDER