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quantum_package/data/inputs/B+.md5

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5240a8b4c7a2938867db5c62bc2d5342 B+.ezfio/ao_basis/ao_coef.gz
081e1982f86eef854e5d55ec79a95222 B+.ezfio/ao_basis/ao_expo.gz
420be386485aa90b2bd2ead516980a11 B+.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
8d835c17bb93dc4b67ed4ec1d7197ffa B+.ezfio/ao_basis/ao_num
099d687364c349911accc3393a170b5c B+.ezfio/ao_basis/ao_power.gz
e089a7d6bb195b6bbf42a8a2ab09705d B+.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b B+.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b B+.ezfio/bielec_integrals/read_ao_integrals
9104e54c37d062209b247e0132dbb74b B+.ezfio/bielec_integrals/read_mo_integrals
0eaedcd23870922f3fb86e923618ebe9 B+.ezfio/bielec_integrals/threshold_ao
2e96b8a0018eba47f00e52bd95a7ca5e B+.ezfio/bielec_integrals/threshold_mo
9104e54c37d062209b247e0132dbb74b B+.ezfio/bielec_integrals/write_ao_integrals
9104e54c37d062209b247e0132dbb74b B+.ezfio/bielec_integrals/write_mo_integrals
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 B+.ezfio/electrons/elec_alpha_num
b8d55a162b3e0811e1c93a1c6f157817 B+.ezfio/electrons/elec_beta_num
728ce7b486375008cd0725f934beed8f B+.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf B+.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb B+.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf B+.ezfio/hartree_fock/thresh_scf
35d497f5924a258041e90eb91a7763fd B+.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 B+.ezfio/mo_basis/mo_label
8d835c17bb93dc4b67ed4ec1d7197ffa B+.ezfio/mo_basis/mo_tot_num
c2866fa287c2b831d8306cb4afc2c2ed B+.ezfio/nuclei/nucl_charge.gz
83d5be29686caaeeeb0fcb63b256838d B+.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
765e1f05dd3fbab8c7ebefaf2f1813e4 B+.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b B+.ezfio/output/empty