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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-45240
  • 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: 20
  • Number of elements: 3
  • Element list: ['Li', 'Fe', 'O']
  • Chemical System: Fe-Li-O
  • Density: 4.036560637847973
  • Atomic Density: 0.10971210856690962
  • Unit Cell Volume: 182.2952840962189
  • Molar Volume: 5.489039303558097
  • Full Formula: Li4 Fe4 O12
  • Reduced Formula: LiFeO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 52
  • Spacegroup Symbol: Pnna
  • Crystal System: orthorhombic
  • Pointgroup: mmm