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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51430
  • 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: 8
  • Number of elements: 2
  • Element list: ['Al', 'F']
  • Chemical System: Al-F
  • Density: 2.739600277396196
  • Atomic Density: 0.07858488858379675
  • Unit Cell Volume: 101.80074240952099
  • Molar Volume: 7.663230003282963
  • Full Formula: Al2 F6
  • Reduced Formula: AlF3
  • Formula Anonymous: AB3
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm