10
0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-07 22:53:52 +01:00
QuantumPackage/src/tc_bi_ortho/print_tc_spin_dens.irp.f

17 lines
453 B
Fortran
Raw Normal View History

2023-02-24 21:38:09 +01:00
program test_spin_dens
implicit none
BEGIN_DOC
! TODO : Reads psi_det in the EZFIO folder and prints out the left- and right-eigenvectors together with the energy. Saves the left-right wave functions at the end.
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 tc_print_mulliken_sd
! call test
end