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quantum_package/data/inputs/C2H2+.md5

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34a8a9d9c267ffe8079173f1163f0221 C2H2+.ezfio/ao_basis/ao_coef.gz
8eb219814257c1aeb9999bf4f6da38f9 C2H2+.ezfio/ao_basis/ao_expo.gz
b627c56b268367da3c85ca268717db35 C2H2+.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
124cdb899e63978aabd1369eebce31a3 C2H2+.ezfio/ao_basis/ao_num
dbde6b8256713f0197b5cc550483ddd1 C2H2+.ezfio/ao_basis/ao_power.gz
ae598b9bf6a73d1d470bb81b4e74b458 C2H2+.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/bielec_integrals/read_ao_integrals
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/bielec_integrals/read_mo_integrals
0eaedcd23870922f3fb86e923618ebe9 C2H2+.ezfio/bielec_integrals/threshold_ao
2e96b8a0018eba47f00e52bd95a7ca5e C2H2+.ezfio/bielec_integrals/threshold_mo
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/bielec_integrals/write_ao_integrals
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/bielec_integrals/write_mo_integrals
2014-04-07 15:12:03 +02:00
4e94260b47ac90ce146cf693b6ea796f C2H2+.ezfio/electrons/elec_alpha_num
503018260a2f6fc8557fcf29300fa8bb C2H2+.ezfio/electrons/elec_beta_num
4c7ba823d3c61eeec19012cf13f7b5bc C2H2+.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf C2H2+.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb C2H2+.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf C2H2+.ezfio/hartree_fock/thresh_scf
48624207c7946873974b27ba28d2cb10 C2H2+.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 C2H2+.ezfio/mo_basis/mo_label
124cdb899e63978aabd1369eebce31a3 C2H2+.ezfio/mo_basis/mo_tot_num
b15a46f5e9a240c7395db9ed29bf9671 C2H2+.ezfio/nuclei/nucl_charge.gz
214ab5e9a34ad5117143e42b47034a38 C2H2+.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
a5ae057cdae95f3930403204a9c9cbe2 C2H2+.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b C2H2+.ezfio/output/empty