# systems

unique_id: 948712bb0cb4b3f973fc2aeea8aac421
username: kokuha
calculator: gpaw
calculator_parameters: {}
key_value_pairs:
  {"Dxc": 0.73, "GLLB_ind": 2.33, "E_uncertanty_perAtom": 0.0, "E_uncertanty_hull": 0.073, "E_relative_perAtom": 0.0, "KS_gap": 1.6, "m_e": 0.284, "TB09_ind": 2.0, "E_hull": 0.126, "short_name": "CdSiP2", "GLLB_dir": 2.33, "lattice": "Tetragonal", "m_h": -0.186, "phase": "CP", "TB09_dir": 2.0, "total_en": -853.06512135}

data:
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