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https://github.com/LCPQ/quantum_package
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27 lines
1.7 KiB
Plaintext
27 lines
1.7 KiB
Plaintext
4469c5da4511bf00803f51a580c9b168 CO.ezfio/ao_basis/ao_coef.gz
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cd3276b733d47fc260c32ca3fad4a0ff CO.ezfio/ao_basis/ao_expo.gz
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679472354ee51100e24911abb3c9ae89 CO.ezfio/ao_basis/ao_nucl.gz
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c9d2e4f9d10db875d4396ee02bce67cb CO.ezfio/ao_basis/ao_num
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9a95866e6794bebf8089dfa404aaf145 CO.ezfio/ao_basis/ao_power.gz
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e71dc791e25c0af61cd0f17ccd80180e CO.ezfio/ao_basis/ao_prim_num.gz
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9104e54c37d062209b247e0132dbb74b CO.ezfio/bielec_integrals/direct
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9104e54c37d062209b247e0132dbb74b CO.ezfio/bielec_integrals/read_ao_integrals
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9104e54c37d062209b247e0132dbb74b CO.ezfio/bielec_integrals/read_mo_integrals
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0eaedcd23870922f3fb86e923618ebe9 CO.ezfio/bielec_integrals/threshold_ao
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2e96b8a0018eba47f00e52bd95a7ca5e CO.ezfio/bielec_integrals/threshold_mo
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9104e54c37d062209b247e0132dbb74b CO.ezfio/bielec_integrals/write_ao_integrals
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9104e54c37d062209b247e0132dbb74b CO.ezfio/bielec_integrals/write_mo_integrals
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4e94260b47ac90ce146cf693b6ea796f CO.ezfio/electrons/elec_alpha_num
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4e94260b47ac90ce146cf693b6ea796f CO.ezfio/electrons/elec_beta_num
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0ed15964c6a6b7641a89300a06c92fbb CO.ezfio/ezfio/creation
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7f367b65714301b397509954da600ecf CO.ezfio/ezfio/library
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c9d2e4f9d10db875d4396ee02bce67cb CO.ezfio/hartree_fock/n_it_scf_max
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872740f77c4607493a0cf5740c3dfddf CO.ezfio/hartree_fock/thresh_scf
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2a7b4562e52ca1477756f036cc0e8dab CO.ezfio/mo_basis/mo_coef.gz
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4b752f0c6bd89811f15963699a6323a0 CO.ezfio/mo_basis/mo_label
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c9d2e4f9d10db875d4396ee02bce67cb CO.ezfio/mo_basis/mo_tot_num
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99f64324cea4e8be125473c3280a8af5 CO.ezfio/nuclei/nucl_charge.gz
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818a7d0eb684263d0f32e2063a6637b1 CO.ezfio/nuclei/nucl_coord.gz
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b8d55a162b3e0811e1c93a1c6f157817 CO.ezfio/nuclei/nucl_num
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9104e54c37d062209b247e0132dbb74b CO.ezfio/output/empty
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