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quantum_package/plugins/eginer/FOBOCI/foboci_reunion.irp.f

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2016-03-11 23:27:39 +01:00
program osoci_program
implicit none
do_it_perturbative = .True.
touch do_it_perturbative
call FOBOCI_lmct_mlct_old_thr
call provide_all_the_rest
end
subroutine provide_all_the_rest
implicit none
integer :: i
call update_one_body_dm_mo
call set_lmct_mlct_to_psi_det
call diagonalize_CI
call save_wavefunction
end