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quantum_package/data/inputs/C2.md5

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3a4a55067bb4b7c35bf81b145de768a6 C2.ezfio/ao_basis/ao_coef.gz
f063639149bc43149efe083edebccd6c C2.ezfio/ao_basis/ao_expo.gz
03a5ee1907868f396106fce935adcf61 C2.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
c9d2e4f9d10db875d4396ee02bce67cb C2.ezfio/ao_basis/ao_num
1f0eee7841471df830ac4f931f661659 C2.ezfio/ao_basis/ao_power.gz
bbc2cde5ff82e7034af269a1cb400a2e C2.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b C2.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b C2.ezfio/bielec_integrals/read_ao_integrals
9104e54c37d062209b247e0132dbb74b C2.ezfio/bielec_integrals/read_mo_integrals
0eaedcd23870922f3fb86e923618ebe9 C2.ezfio/bielec_integrals/threshold_ao
2e96b8a0018eba47f00e52bd95a7ca5e C2.ezfio/bielec_integrals/threshold_mo
9104e54c37d062209b247e0132dbb74b C2.ezfio/bielec_integrals/write_ao_integrals
9104e54c37d062209b247e0132dbb74b C2.ezfio/bielec_integrals/write_mo_integrals
2014-04-07 15:12:03 +02:00
503018260a2f6fc8557fcf29300fa8bb C2.ezfio/electrons/elec_alpha_num
503018260a2f6fc8557fcf29300fa8bb C2.ezfio/electrons/elec_beta_num
4386f2ac54d6c12b5e2970c8e62fd695 C2.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf C2.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb C2.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf C2.ezfio/hartree_fock/thresh_scf
ada048a5b312a0ec414b2a768bcfd8f7 C2.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 C2.ezfio/mo_basis/mo_label
c9d2e4f9d10db875d4396ee02bce67cb C2.ezfio/mo_basis/mo_tot_num
b312295550fcd9655100a171060a05a2 C2.ezfio/nuclei/nucl_charge.gz
1557414d71b969b304bcc786a769478d C2.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 C2.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b C2.ezfio/output/empty