# systems

unique_id: dcffe232670312f16f56bec1949f99ed
username: kokuha
calculator: gpaw
calculator_parameters: {}
key_value_pairs:
  {"E_uncertanty_hull": 0.054, "E_uncertanty_perAtom": 0.0, "m_e": 0.162, "phase": "KT", "GLLB_dir": 2.04, "TB09_dir": 0.31, "GLLB_ind": 2.04, "short_name": "CdGeN2", "TB09_ind": 0.31, "total_en": -939.207978041, "lattice": "Orthorhombic", "Dxc": 0.63, "E_relative_perAtom": 0.0, "KS_gap": 1.42, "m_h": -0.215, "E_hull": -0.043}

data:
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