10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-06 22:24:00 +01:00
quantum_package/data/inputs/B.md5

27 lines
1.6 KiB
Plaintext

5fb58272960ac3c328a1a8c9515c9231 B.ezfio/ao_basis/ao_coef.gz
b63bd2f2370474b04132062eda32d087 B.ezfio/ao_basis/ao_expo.gz
4d95ca5cd8667800df80285387c4e05b B.ezfio/ao_basis/ao_nucl.gz
8d835c17bb93dc4b67ed4ec1d7197ffa B.ezfio/ao_basis/ao_num
873426a4e59e0573e8a953258e3baa79 B.ezfio/ao_basis/ao_power.gz
34f5e950fff5b4c7e27c02290371fe5f B.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b B.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b B.ezfio/bielec_integrals/read_ao_integrals
9104e54c37d062209b247e0132dbb74b B.ezfio/bielec_integrals/read_mo_integrals
0eaedcd23870922f3fb86e923618ebe9 B.ezfio/bielec_integrals/threshold_ao
2e96b8a0018eba47f00e52bd95a7ca5e B.ezfio/bielec_integrals/threshold_mo
9104e54c37d062209b247e0132dbb74b B.ezfio/bielec_integrals/write_ao_integrals
9104e54c37d062209b247e0132dbb74b B.ezfio/bielec_integrals/write_mo_integrals
fc7192d47339d0d2b75886b578c1b041 B.ezfio/electrons/elec_alpha_num
b8d55a162b3e0811e1c93a1c6f157817 B.ezfio/electrons/elec_beta_num
728ce7b486375008cd0725f934beed8f B.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf B.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb B.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf B.ezfio/hartree_fock/thresh_scf
8f288d794d89469c138f61cff9564551 B.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 B.ezfio/mo_basis/mo_label
8d835c17bb93dc4b67ed4ec1d7197ffa B.ezfio/mo_basis/mo_tot_num
4771ac19741cece303b8ca8ea52b9513 B.ezfio/nuclei/nucl_charge.gz
d00fe1cfcea3e45f929a8dbdc49af182 B.ezfio/nuclei/nucl_coord.gz
765e1f05dd3fbab8c7ebefaf2f1813e4 B.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b B.ezfio/output/empty