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https://github.com/LCPQ/quantum_package
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removed prints
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@ -20,8 +20,6 @@ BEGIN_PROVIDER [ integer(bit_kind), psi_phasemask, (N_int, 2, N_det)]
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implicit none
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integer :: i
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print *, "pro"
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print *, "pross"
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do i=1, N_det
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call get_mask_phase(psi_det_sorted(1,1,i), psi_phasemask(1,1,i))
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end do
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@ -73,8 +71,6 @@ subroutine select_connected(i_generator,E0,pt2,b)
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integer(bit_kind) :: hole_mask(N_int,2), particle_mask(N_int,2)
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double precision :: fock_diag_tmp(2,mo_tot_num+1)
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print *, "BEG"
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call build_fock_tmp(fock_diag_tmp,psi_det_generators(1,1,i_generator),N_int)
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@ -90,15 +86,9 @@ subroutine select_connected(i_generator,E0,pt2,b)
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particle_mask(k,:) = hole_mask(k,:)
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enddo
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print *, "sel"
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! call select_doubles(i_generator,hole_mask,particle_mask,fock_diag_tmp,E0,pt2,b)
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print *, "poivre"
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print *, b%cur, b%N
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call select_doubles(i_generator,hole_mask,particle_mask,fock_diag_tmp,E0,pt2,b)
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call select_singles(i_generator,hole_mask,particle_mask,fock_diag_tmp,E0,pt2,b)
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print *, b%cur, b%N
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print *, "paprika"
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enddo
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print *, "safran"
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end subroutine
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