10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-12-23 21:03:56 +01:00
quantum_package/data/inputs/LiO.md5

24 lines
1.5 KiB
Plaintext
Raw Normal View History

f8230d94c3b6ddcea26d3b3bfad0d305 LiO.ezfio/ao_basis/ao_coef.gz
629debd6eaafff9c31495b48c372d25f LiO.ezfio/ao_basis/ao_expo.gz
01433161a4ca2e875ca59a3472efe76f LiO.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
c9d2e4f9d10db875d4396ee02bce67cb LiO.ezfio/ao_basis/ao_num
df137c40f897d763891cd861a62b1e4a LiO.ezfio/ao_basis/ao_power.gz
cbe870ce0bbbb551455fc00d16dabce0 LiO.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b LiO.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b LiO.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 LiO.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b LiO.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
503018260a2f6fc8557fcf29300fa8bb LiO.ezfio/electrons/elec_alpha_num
d765d41448fe246fcc034b66e2768837 LiO.ezfio/electrons/elec_beta_num
81cf76e642d289c65baca4364a332d08 LiO.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf LiO.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb LiO.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf LiO.ezfio/hartree_fock/thresh_scf
dbb497d06320b6360dad3bbb0d3614ea LiO.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 LiO.ezfio/mo_basis/mo_label
c9d2e4f9d10db875d4396ee02bce67cb LiO.ezfio/mo_basis/mo_tot_num
029782675c7e3968c4e433c05ce252d8 LiO.ezfio/nuclei/nucl_charge.gz
43462a48c745dd138cb120d861e78b0a LiO.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 LiO.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b LiO.ezfio/output/empty