mirror of
https://github.com/LCPQ/quantum_package
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24 lines
1.5 KiB
Plaintext
24 lines
1.5 KiB
Plaintext
a00577ae3e58c7fa0416faea2d02c324 H3CCl.ezfio/ao_basis/ao_coef.gz
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412ca4c5ccedd5a8f7127367da8446d0 H3CCl.ezfio/ao_basis/ao_expo.gz
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b39bb8c5dc6bcb78dc326116f0016d04 H3CCl.ezfio/ao_basis/ao_nucl.gz
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05c099f9ecff73ec414553f6a8dba5d5 H3CCl.ezfio/ao_basis/ao_num
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ccd9e4058266b218da85d52bd0f4dbf9 H3CCl.ezfio/ao_basis/ao_power.gz
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de48ee40fc58f56ed9ac1343bba9ae28 H3CCl.ezfio/ao_basis/ao_prim_num.gz
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9104e54c37d062209b247e0132dbb74b H3CCl.ezfio/bielec_integrals/direct
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9104e54c37d062209b247e0132dbb74b H3CCl.ezfio/bielec_integrals/read_ao_integrals
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0eaedcd23870922f3fb86e923618ebe9 H3CCl.ezfio/bielec_integrals/threshold_ao
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9104e54c37d062209b247e0132dbb74b H3CCl.ezfio/bielec_integrals/write_ao_integrals
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5f49c8752062f65b95efea0b53c8dcba H3CCl.ezfio/electrons/elec_alpha_num
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5f49c8752062f65b95efea0b53c8dcba H3CCl.ezfio/electrons/elec_beta_num
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fe9d6554292588b373eec94d01dea0b2 H3CCl.ezfio/ezfio/creation
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7f367b65714301b397509954da600ecf H3CCl.ezfio/ezfio/library
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c9d2e4f9d10db875d4396ee02bce67cb H3CCl.ezfio/hartree_fock/n_it_scf_max
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872740f77c4607493a0cf5740c3dfddf H3CCl.ezfio/hartree_fock/thresh_scf
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7b5fdd0faf36bb6640745ff17ab3a5cb H3CCl.ezfio/mo_basis/mo_coef.gz
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4b752f0c6bd89811f15963699a6323a0 H3CCl.ezfio/mo_basis/mo_label
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05c099f9ecff73ec414553f6a8dba5d5 H3CCl.ezfio/mo_basis/mo_tot_num
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84a46e955dbf0bad92dbd5df96b67cbe H3CCl.ezfio/nuclei/nucl_charge.gz
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45538a2fd7e9b7c2d2919ec75d09e585 H3CCl.ezfio/nuclei/nucl_coord.gz
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d765d41448fe246fcc034b66e2768837 H3CCl.ezfio/nuclei/nucl_num
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9104e54c37d062209b247e0132dbb74b H3CCl.ezfio/output/empty
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