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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1023834
  • 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: 12
  • Number of elements: 3
  • Element list: ['F', 'Lu', 'O']
  • Chemical System: F-Lu-O
  • Density: 8.233463707662988
  • Atomic Density: 0.07084484158966818
  • Unit Cell Volume: 169.38424493209746
  • Molar Volume: 8.50046471256173
  • Full Formula: Lu4 O4 F4
  • Reduced Formula: LuOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 92
  • Spacegroup Symbol: P4_12_12
  • Crystal System: tetragonal
  • Pointgroup: 422