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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52574
  • 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: 10
  • Number of elements: 3
  • Element list: ['Li', 'Cu', 'F']
  • Chemical System: Cu-F-Li
  • Density: 3.3881204238506526
  • Atomic Density: 0.10951968502214486
  • Unit Cell Volume: 91.30778633976168
  • Molar Volume: 5.4986834182205
  • Full Formula: Li4 Cu1 F5
  • Reduced Formula: Li4CuF5
  • Formula Anonymous: AB4C5
  • Spacegroup Number: 87
  • Spacegroup Symbol: I4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m