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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91383
  • 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: 46
  • Number of elements: 3
  • Element list: ['Ti', 'Sn', 'F']
  • Chemical System: F-Sn-Ti
  • Density: 4.681241386338451
  • Atomic Density: 0.060933586207821216
  • Unit Cell Volume: 754.920280633271
  • Molar Volume: 9.883122157722303
  • Full Formula: Ti2 Sn12 F32
  • Reduced Formula: TiSn6F16
  • Formula Anonymous: AB6C16
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m