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qp2/src/mu_of_r/test_proj_op.irp.f
Anthony Scemama d4d4393956
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cas_ful -> cas_full
2023-11-11 16:13:23 +01:00

22 lines
504 B
Fortran

program projected_operators
implicit none
BEGIN_DOC
! TODO
END_DOC
read_wf = .True.
touch read_wf
! You specify that you want to avoid any contribution from
! orbitals coming from core
no_core_density = .True.
touch no_core_density
mu_of_r_potential = "cas_full"
touch mu_of_r_potential
print*,'Using Valence Only functions'
! call test_f_HF_valence_ab
! call routine_full_mos
! call test_f_ii_valence_ab
call test_f_ia_valence_ab
call test_f_ii_ia_aa_valence_ab
end