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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-46911
  • 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', 'Co', 'Ni', 'O']
  • Chemical System: Co-Li-Ni-O
  • Density: 4.920296614401341
  • Atomic Density: 0.12119763015140672
  • Unit Cell Volume: 99.0118369889654
  • Molar Volume: 4.968860160447702
  • Full Formula: Li3 Co2 Ni1 O6
  • Reduced Formula: Li3Co2NiO6
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m