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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52229
  • 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: 20
  • Number of elements: 3
  • Element list: ['Li', 'Cu', 'F']
  • Chemical System: Cu-F-Li
  • Density: 3.220462359851523
  • Atomic Density: 0.0977724059095744
  • Unit Cell Volume: 204.55669280039157
  • Molar Volume: 6.159345987220183
  • Full Formula: Li6 Cu2 F12
  • Reduced Formula: Li3CuF6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3