10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-04 05:03:54 +01:00
quantum_package/data/inputs/O.md5

24 lines
1.4 KiB
Plaintext

dab49fc314cb14cee742e69cdf4b31c3 O.ezfio/ao_basis/ao_coef.gz
e1b0ef95bd5bbc3ae34e122a4f3afcc9 O.ezfio/ao_basis/ao_expo.gz
3d6a62aa78400a34fb8fcafb2aa268a1 O.ezfio/ao_basis/ao_nucl.gz
8d835c17bb93dc4b67ed4ec1d7197ffa O.ezfio/ao_basis/ao_num
c386406d028524ca963ad0b4f6db87b0 O.ezfio/ao_basis/ao_power.gz
74ef00fa3d876df95097ec45f454e838 O.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b O.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b O.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 O.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b O.ezfio/bielec_integrals/write_ao_integrals
d765d41448fe246fcc034b66e2768837 O.ezfio/electrons/elec_alpha_num
fc7192d47339d0d2b75886b578c1b041 O.ezfio/electrons/elec_beta_num
d1c6db31ca3895c3906680120e4dfb74 O.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf O.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb O.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf O.ezfio/hartree_fock/thresh_scf
766febdf9631396241ef2b9778914a41 O.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 O.ezfio/mo_basis/mo_label
8d835c17bb93dc4b67ed4ec1d7197ffa O.ezfio/mo_basis/mo_tot_num
9f46ae526c52b37fa8edc57ec74d0c0a O.ezfio/nuclei/nucl_charge.gz
a5666c3fa72cc77cdcd28ad8625c3db2 O.ezfio/nuclei/nucl_coord.gz
765e1f05dd3fbab8c7ebefaf2f1813e4 O.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b O.ezfio/output/empty