10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-05 05:33:56 +01:00
quantum_package/data/inputs/LiH.md5

24 lines
1.5 KiB
Plaintext
Raw Normal View History

e3f0eb600c6883d88431e77ba636a336 LiH.ezfio/ao_basis/ao_coef.gz
84cbd3f9ccee95a32a1dd63e8103388d LiH.ezfio/ao_basis/ao_expo.gz
b3b93275997ebc31a7724f98915e4c8d LiH.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
1d3287b26b02daefbb941c9d6940348e LiH.ezfio/ao_basis/ao_num
8744daf308fb7d37431c430f30434e37 LiH.ezfio/ao_basis/ao_power.gz
97b6e44c68af80339b39fe77e46e41b8 LiH.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b LiH.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b LiH.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 LiH.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b LiH.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 LiH.ezfio/electrons/elec_alpha_num
b8d55a162b3e0811e1c93a1c6f157817 LiH.ezfio/electrons/elec_beta_num
4c7ba823d3c61eeec19012cf13f7b5bc LiH.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf LiH.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb LiH.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf LiH.ezfio/hartree_fock/thresh_scf
a39ae48355642b1af3d5d44af4cfdd7d LiH.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 LiH.ezfio/mo_basis/mo_label
1d3287b26b02daefbb941c9d6940348e LiH.ezfio/mo_basis/mo_tot_num
824b94faa9c8ef2d911fc227a8458459 LiH.ezfio/nuclei/nucl_charge.gz
24c13a72e88837258ac2ff0325a2bb8c LiH.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 LiH.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b LiH.ezfio/output/empty