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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1287622
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['F', 'Lu', 'O']
  • Chemical System: F-Lu-O
  • Density: 8.882564770595993
  • Atomic Density: 0.07643003193141643
  • Unit Cell Volume: 78.50317275
  • Molar Volume: 7.879285940118273
  • Full Formula: Lu2 O2 F2
  • Reduced Formula: LuOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm