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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1745502
  • Created at: Sept. 4, 2022, 4:02 p.m.
  • Last updated at: Sept. 4, 2022, 4:02 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Ba', 'F', 'Lu']
  • Chemical System: Ba-F-Lu
  • Density: 7.629543921016937
  • Atomic Density: 0.07906288068252523
  • Unit Cell Volume: 139.12976487879553
  • Molar Volume: 7.616900254598281
  • Full Formula: Ba1 Lu2 F8
  • Reduced Formula: BaLu2F8
  • Formula Anonymous: AB2C8
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m