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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117718
  • 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: 4
  • Number of elements: 3
  • Element list: ['Bi', 'O', 'F']
  • Chemical System: Bi-F-O
  • Density: 7.061750932959199
  • Atomic Density: 0.06468538586333814
  • Unit Cell Volume: 61.83776979317809
  • Molar Volume: 9.309893849474863
  • Full Formula: Bi1 O1 F2
  • Reduced Formula: BiOF2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2