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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-498486
  • Created at: Sept. 4, 2022, 3:07 p.m.
  • Last updated at: Sept. 4, 2022, 3:07 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Pb', 'Zn', 'Zr']
  • Chemical System: Pb-Zn-Zr
  • Density: 9.671369108194924
  • Atomic Density: 0.040797884627748526
  • Unit Cell Volume: 98.0442990242542
  • Molar Volume: 14.760914235989736
  • Full Formula: Zr1 Zn1 Pb2
  • Reduced Formula: ZrZnPb2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m