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qp2/src/tc_bi_ortho/tc_cisd_sc2.irp.f

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592 B
Fortran
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2023-02-07 17:07:49 +01:00
program tc_bi_ortho
implicit none
BEGIN_DOC
! TODO : Put the documentation of the program here
END_DOC
print *, 'Hello world'
my_grid_becke = .True.
my_n_pt_r_grid = 30
my_n_pt_a_grid = 50
read_wf = .True.
touch read_wf
touch my_grid_becke my_n_pt_r_grid my_n_pt_a_grid
call test
end
subroutine test
implicit none
! double precision, allocatable :: dressing_dets(:),e_corr_dets(:)
! allocate(dressing_dets(N_det),e_corr_dets(N_det))
! e_corr_dets = 0.d0
! call get_cisd_sc2_dressing(psi_det,e_corr_dets,N_det,dressing_dets)
provide eigval_tc_cisd_sc2_bi_ortho
end