# systems

unique_id: 8e83420fe01d0b0e3c4b85e6b0f970af
username: kokuha
calculator: gpaw
calculator_parameters: {}
key_value_pairs:
  {"E_uncertanty_hull": 0.073, "E_uncertanty_perAtom": 0.007, "m_e": 0.242, "phase": "KT", "GLLB_dir": 2.7, "TB09_dir": 2.35, "GLLB_ind": 2.7, "short_name": "CdSiP2", "TB09_ind": 2.29, "total_en": -852.962116264, "lattice": "Orthorhombic", "Dxc": 0.81, "E_relative_perAtom": 0.006, "KS_gap": 1.89, "m_h": -0.164, "E_hull": 0.126}

data:
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