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quantum_package/data/inputs/NSi.md5

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0fb9151590d465ab26a1de81a2c3299c NSi.ezfio/ao_basis/ao_coef.gz
be6a9fbbd361caefaf91a049d1415ad9 NSi.ezfio/ao_basis/ao_expo.gz
fc12922081dcaa6450343599244f3242 NSi.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
3684cba18cb251696e3efbe2a411ff51 NSi.ezfio/ao_basis/ao_num
d0b259b57be2fd19d1dc8463fed6f5da NSi.ezfio/ao_basis/ao_power.gz
c4aa02fe7d7495d077732cd8bcf7ac39 NSi.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b NSi.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b NSi.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 NSi.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b NSi.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
86a89aacd3c5e8bdec809a62620500e9 NSi.ezfio/electrons/elec_alpha_num
b5e150f8a5f428ced2b7812819cd43b0 NSi.ezfio/electrons/elec_beta_num
fe9d6554292588b373eec94d01dea0b2 NSi.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf NSi.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb NSi.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf NSi.ezfio/hartree_fock/thresh_scf
d2d30398ce5acb27d79a7d4b649c69bf NSi.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 NSi.ezfio/mo_basis/mo_label
3684cba18cb251696e3efbe2a411ff51 NSi.ezfio/mo_basis/mo_tot_num
fa04ca51b515d5ffcfa567985ed25b8c NSi.ezfio/nuclei/nucl_charge.gz
6d92d1f686fce32e85709f6e402c2ccc NSi.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 NSi.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b NSi.ezfio/output/empty