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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-120581
  • 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: 22
  • Number of elements: 3
  • Element list: ['Li', 'Cr', 'F']
  • Chemical System: Cr-F-Li
  • Density: 2.948866800847941
  • Atomic Density: 0.10082213013067146
  • Unit Cell Volume: 218.20606221557406
  • Molar Volume: 5.973034642488657
  • Full Formula: Li8 Cr2 F12
  • Reduced Formula: Li4CrF6
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m