mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-06-02 02:35:18 +02:00
15 lines
290 B
Fortran
15 lines
290 B
Fortran
! Generates subroutine H_apply_cis
|
|
! --------------------------------
|
|
|
|
BEGIN_SHELL [ /usr/bin/env python3 ]
|
|
from generate_h_apply import H_apply
|
|
H = H_apply("cis",do_double_exc=False)
|
|
print(H)
|
|
|
|
H = H_apply("cis_sym",do_double_exc=False)
|
|
H.filter_only_connected_to_hf()
|
|
print(H)
|
|
|
|
END_SHELL
|
|
|