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https://github.com/LCPQ/quantum_package
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24 lines
1.5 KiB
Plaintext
24 lines
1.5 KiB
Plaintext
4a99bf71c4cc7a9f3a97372aee792896 NH4+.ezfio/ao_basis/ao_coef.gz
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ecf24d8a61d24b8003e44d24614ce087 NH4+.ezfio/ao_basis/ao_expo.gz
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eb0a92c8b7cc96269d67cd9c8cc5cd5a NH4+.ezfio/ao_basis/ao_nucl.gz
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ea2a34d42beeb57bfa1b3f55ec5280ef NH4+.ezfio/ao_basis/ao_num
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fc1b5324e798112ee755a9088bc2b5a6 NH4+.ezfio/ao_basis/ao_power.gz
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4cbad2712a81d84070e3327c4958cc06 NH4+.ezfio/ao_basis/ao_prim_num.gz
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9104e54c37d062209b247e0132dbb74b NH4+.ezfio/bielec_integrals/direct
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9104e54c37d062209b247e0132dbb74b NH4+.ezfio/bielec_integrals/read_ao_integrals
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0eaedcd23870922f3fb86e923618ebe9 NH4+.ezfio/bielec_integrals/threshold_ao
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9104e54c37d062209b247e0132dbb74b NH4+.ezfio/bielec_integrals/write_ao_integrals
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d765d41448fe246fcc034b66e2768837 NH4+.ezfio/electrons/elec_alpha_num
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d765d41448fe246fcc034b66e2768837 NH4+.ezfio/electrons/elec_beta_num
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fe9d6554292588b373eec94d01dea0b2 NH4+.ezfio/ezfio/creation
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7f367b65714301b397509954da600ecf NH4+.ezfio/ezfio/library
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c9d2e4f9d10db875d4396ee02bce67cb NH4+.ezfio/hartree_fock/n_it_scf_max
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872740f77c4607493a0cf5740c3dfddf NH4+.ezfio/hartree_fock/thresh_scf
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2f8583612d4f3cf8368676c273d73528 NH4+.ezfio/mo_basis/mo_coef.gz
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4b752f0c6bd89811f15963699a6323a0 NH4+.ezfio/mo_basis/mo_label
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ea2a34d42beeb57bfa1b3f55ec5280ef NH4+.ezfio/mo_basis/mo_tot_num
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7f26d90a932d2e819d7a6f90fd57ff38 NH4+.ezfio/nuclei/nucl_charge.gz
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8c3867d7c90e8a4c1bec7a81c7dbec12 NH4+.ezfio/nuclei/nucl_coord.gz
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d765d41448fe246fcc034b66e2768837 NH4+.ezfio/nuclei/nucl_num
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9104e54c37d062209b247e0132dbb74b NH4+.ezfio/output/empty
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