10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-04 05:03:54 +01:00
quantum_package/data/inputs/H2CO.md5

24 lines
1.5 KiB
Plaintext

f7232108a608812d9322207e761efbb0 H2CO.ezfio/ao_basis/ao_coef.gz
d07184054ec62451b15413c07fc8372d H2CO.ezfio/ao_basis/ao_expo.gz
ea75987db79ba98d3a7ba329900788e5 H2CO.ezfio/ao_basis/ao_nucl.gz
124cdb899e63978aabd1369eebce31a3 H2CO.ezfio/ao_basis/ao_num
6539208584f4091212b8578f6cbd200c H2CO.ezfio/ao_basis/ao_power.gz
ab06c825d151ab7ce9d4baedb12af850 H2CO.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b H2CO.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b H2CO.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 H2CO.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b H2CO.ezfio/bielec_integrals/write_ao_integrals
6156a0908e61aaf7a450978fcd37322d H2CO.ezfio/electrons/elec_alpha_num
6156a0908e61aaf7a450978fcd37322d H2CO.ezfio/electrons/elec_beta_num
fe9d6554292588b373eec94d01dea0b2 H2CO.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf H2CO.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb H2CO.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf H2CO.ezfio/hartree_fock/thresh_scf
cf1f7771c37be6847e8c4d48e43bcdc7 H2CO.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 H2CO.ezfio/mo_basis/mo_label
124cdb899e63978aabd1369eebce31a3 H2CO.ezfio/mo_basis/mo_tot_num
cf78868b02b476d40209fbb8cd795e49 H2CO.ezfio/nuclei/nucl_charge.gz
7294f8131d8f51fe50fdedc03eaf94a6 H2CO.ezfio/nuclei/nucl_coord.gz
a5ae057cdae95f3930403204a9c9cbe2 H2CO.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b H2CO.ezfio/output/empty