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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100467
  • 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: 7
  • Number of elements: 4
  • Element list: ['Li', 'Fe', 'Cl', 'O']
  • Chemical System: Cl-Fe-Li-O
  • Density: 3.421206356804626
  • Atomic Density: 0.06510049562988436
  • Unit Cell Volume: 107.52606308555741
  • Molar Volume: 9.250529818140953
  • Full Formula: Li1 Fe2 Cl2 O2
  • Reduced Formula: LiFe2(ClO)2
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2