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quantum_package/data/inputs/BS.md5

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b141cdfb8074b5f033a8518fc39462d1 BS.ezfio/ao_basis/ao_coef.gz
81c8bef530cca7d5222f5cef3e138fac BS.ezfio/ao_basis/ao_expo.gz
5101acb8ba56fd729d7a3b10f53e4f63 BS.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
3684cba18cb251696e3efbe2a411ff51 BS.ezfio/ao_basis/ao_num
82209cff4db4d15f6ee4bf8d6719135b BS.ezfio/ao_basis/ao_power.gz
e2993208ce139787751e3494a06b0ff8 BS.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b BS.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b BS.ezfio/bielec_integrals/read_ao_integrals
9104e54c37d062209b247e0132dbb74b BS.ezfio/bielec_integrals/read_mo_integrals
0eaedcd23870922f3fb86e923618ebe9 BS.ezfio/bielec_integrals/threshold_ao
2e96b8a0018eba47f00e52bd95a7ca5e BS.ezfio/bielec_integrals/threshold_mo
9104e54c37d062209b247e0132dbb74b BS.ezfio/bielec_integrals/write_ao_integrals
9104e54c37d062209b247e0132dbb74b BS.ezfio/bielec_integrals/write_mo_integrals
2014-04-07 15:12:03 +02:00
86a89aacd3c5e8bdec809a62620500e9 BS.ezfio/electrons/elec_alpha_num
b5e150f8a5f428ced2b7812819cd43b0 BS.ezfio/electrons/elec_beta_num
4c7ba823d3c61eeec19012cf13f7b5bc BS.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf BS.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb BS.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf BS.ezfio/hartree_fock/thresh_scf
e422ae48eb0849604e7ab7257b7c640b BS.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 BS.ezfio/mo_basis/mo_label
3684cba18cb251696e3efbe2a411ff51 BS.ezfio/mo_basis/mo_tot_num
b60ff00009c9c8d0dab1d7a9d7871f56 BS.ezfio/nuclei/nucl_charge.gz
3f9bc51b5898e00f3a2978f7935efde1 BS.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 BS.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b BS.ezfio/output/empty