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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-110393
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ce', 'O', 'F']
  • Chemical System: Ce-F-O
  • Density: 6.402857246171157
  • Atomic Density: 0.06605802668550656
  • Unit Cell Volume: 90.82923455411708
  • Molar Volume: 9.116440593465814
  • Full Formula: Ce2 O2 F2
  • Reduced Formula: CeOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm