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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42524
  • 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: 12
  • Number of elements: 4
  • Element list: ['Li', 'Fe', 'O', 'F']
  • Chemical System: F-Fe-Li-O
  • Density: 3.7842410247507168
  • Atomic Density: 0.11326261772514691
  • Unit Cell Volume: 105.94846067499748
  • Molar Volume: 5.3169711957513295
  • Full Formula: Li4 Fe2 O4 F2
  • Reduced Formula: Li2FeO2F
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m