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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1443380
  • Created at: Sept. 4, 2022, 3:50 p.m.
  • Last updated at: Sept. 4, 2022, 3:50 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 24
  • Number of elements: 2
  • Element list: ['As', 'F']
  • Chemical System: As-F
  • Density: 8.593728359187729
  • Atomic Density: 0.1827492454169781
  • Unit Cell Volume: 131.32749164156226
  • Molar Volume: 3.2953026680133806
  • Full Formula: As4 F20
  • Reduced Formula: AsF5
  • Formula Anonymous: AB5
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm