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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-33317
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['B', 'H', 'O', 'F']
  • Chemical System: B-F-H-O
  • Density: 2.0281075938135937
  • Atomic Density: 0.1176225864656628
  • Unit Cell Volume: 340.070739829183
  • Molar Volume: 5.119884659021696
  • Full Formula: B4 H16 O8 F12
  • Reduced Formula: BH4O2F3
  • Formula Anonymous: AB2C3D4
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m