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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1282792
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 96
  • Number of elements: 4
  • Element list: ['Ce', 'Li', 'O', 'Zr']
  • Chemical System: Ce-Li-O-Zr
  • Density: 5.3151187531743895
  • Atomic Density: 0.09108649301664085
  • Unit Cell Volume: 1053.9433105900948
  • Molar Volume: 6.611453093160365
  • Full Formula: Li28 Ce12 Zr8 O48
  • Reduced Formula: Li7Ce3Zr2O12
  • Formula Anonymous: A2B3C7D12
  • Spacegroup Number: 142
  • Spacegroup Symbol: I4_1/acd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm