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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24644
  • 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: 12
  • Number of elements: 2
  • Element list: ['Br', 'F']
  • Chemical System: Br-F
  • Density: 3.2367194632312954
  • Atomic Density: 0.0668693798546441
  • Unit Cell Volume: 179.45433359909643
  • Molar Volume: 9.005827141047968
  • Full Formula: Br2 F10
  • Reduced Formula: BrF5
  • Formula Anonymous: AB5
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2