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quantum_package/data/inputs/LiF.md5

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07c686d1b85e3b6a6917e5adb74a6df3 LiF.ezfio/ao_basis/ao_coef.gz
3bda0ca69711404c036f82dddf3b73ac LiF.ezfio/ao_basis/ao_expo.gz
13f81af228bf62cdc2cbd35fbfccf642 LiF.ezfio/ao_basis/ao_nucl.gz
2014-04-07 15:12:03 +02:00
c9d2e4f9d10db875d4396ee02bce67cb LiF.ezfio/ao_basis/ao_num
0ac0cc4b0916e62d94e3dc0a0a72b0b5 LiF.ezfio/ao_basis/ao_power.gz
1409379121d5677226c09633b5ecf74c LiF.ezfio/ao_basis/ao_prim_num.gz
9104e54c37d062209b247e0132dbb74b LiF.ezfio/bielec_integrals/direct
9104e54c37d062209b247e0132dbb74b LiF.ezfio/bielec_integrals/read_ao_integrals
0eaedcd23870922f3fb86e923618ebe9 LiF.ezfio/bielec_integrals/threshold_ao
9104e54c37d062209b247e0132dbb74b LiF.ezfio/bielec_integrals/write_ao_integrals
2014-04-07 15:12:03 +02:00
503018260a2f6fc8557fcf29300fa8bb LiF.ezfio/electrons/elec_alpha_num
503018260a2f6fc8557fcf29300fa8bb LiF.ezfio/electrons/elec_beta_num
ed6cba5f0f7b3dac2582bc2992ad1fce LiF.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf LiF.ezfio/ezfio/library
c9d2e4f9d10db875d4396ee02bce67cb LiF.ezfio/hartree_fock/n_it_scf_max
872740f77c4607493a0cf5740c3dfddf LiF.ezfio/hartree_fock/thresh_scf
aac3e55880ea50e428c103f28b713560 LiF.ezfio/mo_basis/mo_coef.gz
2014-04-07 15:12:03 +02:00
4b752f0c6bd89811f15963699a6323a0 LiF.ezfio/mo_basis/mo_label
c9d2e4f9d10db875d4396ee02bce67cb LiF.ezfio/mo_basis/mo_tot_num
0463696b3b25bac2d9dbbb9ac6032074 LiF.ezfio/nuclei/nucl_charge.gz
d00ae66dc979168f7394138cce71c605 LiF.ezfio/nuclei/nucl_coord.gz
2014-04-07 15:12:03 +02:00
b8d55a162b3e0811e1c93a1c6f157817 LiF.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b LiF.ezfio/output/empty