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quantum_package/data/inputs/SH2.md5

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1.5 KiB
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c7be572270b5d82d0734e14948cacc42 SH2.ezfio/ao_basis/ao_coef.gz
d63e054e1208b656af02f7d67239691b SH2.ezfio/ao_basis/ao_expo.gz
7b0d5cec5b9f04dcf314eae7e9d8da65 SH2.ezfio/ao_basis/ao_nucl.gz
4060e3d8c144f496022427a2c22aeb85 SH2.ezfio/ao_basis/ao_num
e4114fbbb51953d84a913de5f9edec5f SH2.ezfio/ao_basis/ao_power.gz
44606cd0531217985a7931d93cf5f9a3 SH2.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b SH2.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b SH2.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 SH2.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b SH2.ezfio/bielec_integrals/write_ao_integrals
6ddd54f604d3a6c6e28eebd0b6e08ddc SH2.ezfio/electrons/elec_alpha_num
6ddd54f604d3a6c6e28eebd0b6e08ddc SH2.ezfio/electrons/elec_beta_num
ed6cba5f0f7b3dac2582bc2992ad1fce SH2.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf SH2.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb SH2.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf SH2.ezfio/hartree_fock/thresh_scf
9641dd90622e033bf17be57b8fcc8645 SH2.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 SH2.ezfio/mo_basis/mo_label
4060e3d8c144f496022427a2c22aeb85 SH2.ezfio/mo_basis/mo_tot_num
01738c5d5fa96ebf2094e200d9f136af SH2.ezfio/nuclei/nucl_charge.gz
6f897983aca3ae4c960f1f39b1f1e91e SH2.ezfio/nuclei/nucl_coord.gz
fc7192d47339d0d2b75886b578c1b041 SH2.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b SH2.ezfio/output/empty