# systems

unique_id: 3b69fbb2992735333deac633f565189f
username: kokuha
calculator: gpaw
calculator_parameters: {}
key_value_pairs:
  {"E_uncertanty_hull": 0.05, "E_uncertanty_perAtom": 0.008, "m_e": 0.2, "phase": "KT", "GLLB_dir": 1.83, "TB09_dir": 1.86, "GLLB_ind": 1.73, "short_name": "ZnGeP2", "TB09_ind": 1.65, "total_en": -761.071942532, "lattice": "Orthorhombic", "Dxc": 0.49, "E_relative_perAtom": 0.015, "KS_gap": 1.23, "m_h": -0.121, "E_hull": 0.037}

data:
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