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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-17272
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Ga', 'Ni', 'Ti']
  • Chemical System: Ga-Ni-Ti
  • Density: 7.026146415429055
  • Atomic Density: 0.0720075334297594
  • Unit Cell Volume: 124.98692249720173
  • Molar Volume: 8.363209338192885
  • Full Formula: Ti3 Ga3 Ni3
  • Reduced Formula: TiGaNi
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m