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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1442951
  • Created at: Sept. 4, 2022, 3:50 p.m.
  • Last updated at: Sept. 4, 2022, 3:50 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['F', 'Sc']
  • Chemical System: F-Sc
  • Density: 3.6486119476809704
  • Atomic Density: 0.08620779993516332
  • Unit Cell Volume: 92.79902753598607
  • Molar Volume: 6.985610077660301
  • Full Formula: Sc2 F6
  • Reduced Formula: ScF3
  • Formula Anonymous: AB3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m