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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-43602
  • 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: 12
  • Number of elements: 3
  • Element list: ['Li', 'Fe', 'F']
  • Chemical System: F-Fe-Li
  • Density: 3.483982918520966
  • Atomic Density: 0.09070944265389735
  • Unit Cell Volume: 132.29052730250038
  • Molar Volume: 6.638934805252337
  • Full Formula: Li2 Fe2 F8
  • Reduced Formula: LiFeF4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 50
  • Spacegroup Symbol: Pban1
  • Crystal System: orthorhombic
  • Pointgroup: mmm