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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-40729
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 4
  • Element list: ['Li', 'Al', 'Cr', 'O']
  • Chemical System: Al-Cr-Li-O
  • Density: 3.667630303440282
  • Atomic Density: 0.11897186647760861
  • Unit Cell Volume: 100.86418205650736
  • Molar Volume: 5.061819183221281
  • Full Formula: Li3 Al2 Cr1 O6
  • Reduced Formula: Li3Al2CrO6
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m