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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-383771
  • Created at: Sept. 4, 2022, 2:54 p.m.
  • Last updated at: Sept. 4, 2022, 2:54 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['La', 'Ni', 'Th']
  • Chemical System: La-Ni-Th
  • Density: 8.896321004005237
  • Atomic Density: 0.03769280697501429
  • Unit Cell Volume: 106.12104327097502
  • Molar Volume: 15.97689650439656
  • Full Formula: La2 Th1 Ni1
  • Reduced Formula: La2ThNi
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m