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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1025782
  • Created at: Sept. 4, 2022, 3:28 p.m.
  • Last updated at: Sept. 4, 2022, 3:28 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ac', 'F', 'O']
  • Chemical System: Ac-F-O
  • Density: 8.421471199376542
  • Atomic Density: 0.05807142392076862
  • Unit Cell Volume: 103.32104148481478
  • Molar Volume: 10.370230921522566
  • Full Formula: Ac2 O2 F2
  • Reduced Formula: AcOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m