10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-07 14:43:56 +01:00
quantum_package/data/inputs/HNO.md5

24 lines
1.5 KiB
Plaintext
Raw Normal View History

0a1f7a06488fdde410c6ff2a3dc05d69 HNO.ezfio/ao_basis/ao_coef.gz
9b22ca21f37cc4ce95a9fd45e145fca0 HNO.ezfio/ao_basis/ao_expo.gz
3149a0966f1ffeeb191b74dce04759e7 HNO.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
ea2a34d42beeb57bfa1b3f55ec5280ef HNO.ezfio/ao_basis/ao_num
b5b7955e3421a7ac2e2458444995b2cc HNO.ezfio/ao_basis/ao_power.gz
e39b7f009118c95a414c928372ac4b02 HNO.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b HNO.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b HNO.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 HNO.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b HNO.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
6156a0908e61aaf7a450978fcd37322d HNO.ezfio/electrons/elec_alpha_num
6156a0908e61aaf7a450978fcd37322d HNO.ezfio/electrons/elec_beta_num
ed6cba5f0f7b3dac2582bc2992ad1fce HNO.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf HNO.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb HNO.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf HNO.ezfio/hartree_fock/thresh_scf
3bd0b665921133a9734a47ca20b74924 HNO.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 HNO.ezfio/mo_basis/mo_label
ea2a34d42beeb57bfa1b3f55ec5280ef HNO.ezfio/mo_basis/mo_tot_num
dc798ccdd8d453149272af9b0d2f22cf HNO.ezfio/nuclei/nucl_charge.gz
69be144265ed92b3258d6da829f17076 HNO.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
fc7192d47339d0d2b75886b578c1b041 HNO.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b HNO.ezfio/output/empty