10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-12-23 12:56:14 +01:00
quantum_package/data/inputs/SH2+.md5

24 lines
1.5 KiB
Plaintext
Raw Normal View History

b6362188c55f282f009bbd751ae2f35c SH2+.ezfio/ao_basis/ao_coef.gz
15df1fe1fd7897d1e8faabafcf40abae SH2+.ezfio/ao_basis/ao_expo.gz
ca8905ef3f1539a419a0c75a4bb58a65 SH2+.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
4060e3d8c144f496022427a2c22aeb85 SH2+.ezfio/ao_basis/ao_num
980ecbe4dd6ad385dec4323d08568774 SH2+.ezfio/ao_basis/ao_power.gz
cfd8b1da14f950e169b9a5dd640d9a57 SH2+.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b SH2+.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b SH2+.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 SH2+.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b SH2+.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
6ddd54f604d3a6c6e28eebd0b6e08ddc SH2+.ezfio/electrons/elec_alpha_num
6156a0908e61aaf7a450978fcd37322d SH2+.ezfio/electrons/elec_beta_num
ed6cba5f0f7b3dac2582bc2992ad1fce SH2+.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf SH2+.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb SH2+.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf SH2+.ezfio/hartree_fock/thresh_scf
533cb8206918a1b5eafc0057734c895f SH2+.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 SH2+.ezfio/mo_basis/mo_label
4060e3d8c144f496022427a2c22aeb85 SH2+.ezfio/mo_basis/mo_tot_num
31e8304fd2118d697c810d39b84fe176 SH2+.ezfio/nuclei/nucl_charge.gz
84fc4ba4b382bfa5ad35f00072c9e6af SH2+.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
fc7192d47339d0d2b75886b578c1b041 SH2+.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b SH2+.ezfio/output/empty