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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1738214
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 13
  • Number of elements: 4
  • Element list: ['Li', 'Ni', 'O', 'Sc']
  • Chemical System: Li-Ni-O-Sc
  • Density: 4.840107147183465
  • Atomic Density: 0.10644689833927824
  • Unit Cell Volume: 122.12662090505535
  • Molar Volume: 5.657413089487707
  • Full Formula: Li1 Sc1 Ni3 O8
  • Reduced Formula: LiScNi3O8
  • Formula Anonymous: ABC3D8
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1