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quantum_package/data/inputs/Si-.md5

24 lines
1.5 KiB
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b70d138fc5a5a73a5ee2a6bfa54df433 Si-.ezfio/ao_basis/ao_coef.gz
0ae34d66a8dc8f5850bb727d1ab01bb7 Si-.ezfio/ao_basis/ao_expo.gz
17cb9ca06b00ee7e5e773c30220fde9b Si-.ezfio/ao_basis/ao_nucl.gz
a62103800a061f58b2b696f7c5119e54 Si-.ezfio/ao_basis/ao_num
350b153b874e36577b480de2d3d84109 Si-.ezfio/ao_basis/ao_power.gz
2a93cdb57209055bb3777ac48bcdea91 Si-.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b Si-.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b Si-.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 Si-.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b Si-.ezfio/bielec_integrals/write_ao_integrals
6ddd54f604d3a6c6e28eebd0b6e08ddc Si-.ezfio/electrons/elec_alpha_num
503018260a2f6fc8557fcf29300fa8bb Si-.ezfio/electrons/elec_beta_num
4c7ba823d3c61eeec19012cf13f7b5bc Si-.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf Si-.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb Si-.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf Si-.ezfio/hartree_fock/thresh_scf
fada867742d3ecbe3fec5931bf44841d Si-.ezfio/mo_basis/mo_coef.gz
4b752f0c6bd89811f15963699a6323a0 Si-.ezfio/mo_basis/mo_label
a62103800a061f58b2b696f7c5119e54 Si-.ezfio/mo_basis/mo_tot_num
abdee8c25b4cfe6efb86063f71b94355 Si-.ezfio/nuclei/nucl_charge.gz
2e42cd0b831f5b9c27988bd28b20190f Si-.ezfio/nuclei/nucl_coord.gz
765e1f05dd3fbab8c7ebefaf2f1813e4 Si-.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b Si-.ezfio/output/empty