10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-06-20 12:12:13 +02:00
quantum_package/data/inputs/Na+.md5

24 lines
1.5 KiB
Plaintext

c933025d58400724413b20a693e22114 Na+.ezfio/ao_basis/ao_coef.gz
21f6cd145a5b719ee707526355e94f04 Na+.ezfio/ao_basis/ao_expo.gz
a25665fb829c118c00f95ee791b4675c Na+.ezfio/ao_basis/ao_nucl.gz
a62103800a061f58b2b696f7c5119e54 Na+.ezfio/ao_basis/ao_num
dc9e902440fb2d48a067b2af9f65d011 Na+.ezfio/ao_basis/ao_power.gz
036a9913dc5018deac30d1f11efde502 Na+.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b Na+.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b Na+.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 Na+.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b Na+.ezfio/bielec_integrals/write_ao_integrals
d765d41448fe246fcc034b66e2768837 Na+.ezfio/electrons/elec_alpha_num
d765d41448fe246fcc034b66e2768837 Na+.ezfio/electrons/elec_beta_num
f33138f33a3baac41e36a2a9cfd25932 Na+.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf Na+.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb Na+.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf Na+.ezfio/hartree_fock/thresh_scf
ab352fb060fa9d467b2443049f0a8d63 Na+.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 Na+.ezfio/mo_basis/mo_label
a62103800a061f58b2b696f7c5119e54 Na+.ezfio/mo_basis/mo_tot_num
a3be7a1e93d99338f45bb00c42810289 Na+.ezfio/nuclei/nucl_charge.gz
4b8af1d600abb1acb61cea1a29083a1f Na+.ezfio/nuclei/nucl_coord.gz
765e1f05dd3fbab8c7ebefaf2f1813e4 Na+.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b Na+.ezfio/output/empty