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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117433
  • 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: 12
  • Number of elements: 4
  • Element list: ['Li', 'Fe', 'Ni', 'O']
  • Chemical System: Fe-Li-Ni-O
  • Density: 4.792457436362719
  • Atomic Density: 0.12058734780326123
  • Unit Cell Volume: 99.51292750528066
  • Molar Volume: 4.994007140637298
  • Full Formula: Li3 Fe2 Ni1 O6
  • Reduced Formula: Li3Fe2NiO6
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m