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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1018322
  • Created at: Sept. 4, 2022, 3:27 p.m.
  • Last updated at: Sept. 4, 2022, 3:27 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ce', 'F', 'O']
  • Chemical System: Ce-F-O
  • Density: 6.166759652132782
  • Atomic Density: 0.06362221708242705
  • Unit Cell Volume: 94.30667894246092
  • Molar Volume: 9.465468253327126
  • Full Formula: Ce2 O2 F2
  • Reduced Formula: CeOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm