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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97858
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 32
  • Number of elements: 4
  • Element list: ['B', 'N', 'O', 'F']
  • Chemical System: B-F-N-O
  • Density: 2.320010593024359
  • Atomic Density: 0.08415883439088225
  • Unit Cell Volume: 380.2334030836681
  • Molar Volume: 7.155684609448961
  • Full Formula: B4 N4 O8 F16
  • Reduced Formula: BN(OF2)2
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m