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qp2/plugins/local/tc_progs/print_tc_var.irp.f

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467 B
Fortran
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program print_tc_var
BEGIN_DOC
! TODO : Put the documentation of the program here
END_DOC
implicit none
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print *, ' TC VAR is available only for HF REF WF'
print *, ' DO NOT FORGET TO RUN A CISD CALCULATION BEF'
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my_grid_becke = .True.
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PROVIDE tc_grid1_a tc_grid1_r
my_n_pt_r_grid = tc_grid1_r
my_n_pt_a_grid = tc_grid1_a
touch my_grid_becke my_n_pt_r_grid my_n_pt_a_grid
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read_wf = .True.
touch read_wf
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call write_tc_gs_var_HF()
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end