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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-92251
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Li', 'Bi', 'F']
  • Chemical System: Bi-F-Li
  • Density: 4.368060134010702
  • Atomic Density: 0.06620659436550949
  • Unit Cell Volume: 120.8338848519238
  • Molar Volume: 9.09598328944896
  • Full Formula: Li2 Bi1 F5
  • Reduced Formula: Li2BiF5
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 79
  • Spacegroup Symbol: I4
  • Crystal System: tetragonal
  • Pointgroup: 4