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qp_plugins_scemama/devel/cassdtq/cassdtq.irp.f

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2019-08-25 12:21:05 +02:00
program cassdtq
implicit none
BEGIN_DOC
! Selected CISDTQ with stochastic selection and PT2.
END_DOC
if (.not.is_zmq_slave) then
PROVIDE psi_det psi_coef mo_two_e_integrals_in_map
if (do_pt2) then
call run_stochastic_cipsi
else
call run_cipsi
endif
else
PROVIDE mo_two_e_integrals_in_map
call run_slave_cipsi
endif
end