10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-07 14:43:56 +01:00
quantum_package/data/inputs/PH2.md5

24 lines
1.5 KiB
Plaintext

a6dba7fe131568f58a18654dc620c55e PH2.ezfio/ao_basis/ao_coef.gz
f2695616ec4f4ea7f8b93cb427509231 PH2.ezfio/ao_basis/ao_expo.gz
faa792afcfee3e8e006f9e5a9b08d31e PH2.ezfio/ao_basis/ao_nucl.gz
4060e3d8c144f496022427a2c22aeb85 PH2.ezfio/ao_basis/ao_num
d98c8f7bb4d4b05d13797fb02b60f0df PH2.ezfio/ao_basis/ao_power.gz
f4c0a0a52a7b1d1d72db5d0d2f78d1aa PH2.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b PH2.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b PH2.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 PH2.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b PH2.ezfio/bielec_integrals/write_ao_integrals
6ddd54f604d3a6c6e28eebd0b6e08ddc PH2.ezfio/electrons/elec_alpha_num
6156a0908e61aaf7a450978fcd37322d PH2.ezfio/electrons/elec_beta_num
ed6cba5f0f7b3dac2582bc2992ad1fce PH2.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf PH2.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb PH2.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf PH2.ezfio/hartree_fock/thresh_scf
3daae72be71fbd6db5f46a5cb66645cb PH2.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 PH2.ezfio/mo_basis/mo_label
4060e3d8c144f496022427a2c22aeb85 PH2.ezfio/mo_basis/mo_tot_num
70717ca33c9177827088f016207e0125 PH2.ezfio/nuclei/nucl_charge.gz
1ebb3f1292462fdfa2b4d9685fc30620 PH2.ezfio/nuclei/nucl_coord.gz
fc7192d47339d0d2b75886b578c1b041 PH2.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b PH2.ezfio/output/empty