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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-350820
  • Created at: Sept. 4, 2022, 2:54 p.m.
  • Last updated at: Sept. 4, 2022, 2:54 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ac', 'B', 'O']
  • Chemical System: Ac-B-O
  • Density: 5.248847966349282
  • Atomic Density: 0.055297907296403714
  • Unit Cell Volume: 90.419334916227
  • Molar Volume: 10.890359245822037
  • Full Formula: Ac1 B1 O3
  • Reduced Formula: AcBO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m