mirror of
https://github.com/LCPQ/quantum_package
synced 2024-10-06 00:06:19 +02:00
9 lines
333 B
Plaintext
9 lines
333 B
Plaintext
mo_basis
|
|
mo_tot_num integer
|
|
mo_coef double precision (ao_basis_ao_num,mo_basis_mo_tot_num)
|
|
mo_energy double precision (mo_basis_mo_tot_num)
|
|
mo_occ double precision (mo_basis_mo_tot_num)
|
|
mo_symmetry character*(8) (mo_basis_mo_tot_num)
|
|
mo_label character*(64)
|
|
|