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quantum_package/plugins/QMC/densify_coefmatrix.irp.f

19 lines
397 B
Fortran

program densify
implicit none
read_wf = .True.
touch read_wf
call generate_all_alpha_beta_det_products()
! call wf_of_psi_bilinear_matrix(.False.)
! integer :: i, istate
! do istate=1,N_states
! do i=1,N_det
! if (psi_coef(i,istate) == 0.d0) then
! psi_coef(i,istate) = 1.d-6
! endif
! enddo
! enddo
call diagonalize_ci
call save_wavefunction
end