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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-53414
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Tl', 'Bi', 'F']
  • Chemical System: Bi-F-Tl
  • Density: 8.224333190015058
  • Atomic Density: 0.060726292444026615
  • Unit Cell Volume: 197.6079802840061
  • Molar Volume: 9.916858938079914
  • Full Formula: Tl2 Bi2 F8
  • Reduced Formula: TlBiF4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m