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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-758437
  • Created at: Sept. 4, 2022, 3:22 p.m.
  • Last updated at: Sept. 4, 2022, 3:22 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 24
  • Number of elements: 2
  • Element list: ['Zn', 'Zr']
  • Chemical System: Zn-Zr
  • Density: 6.671219145454578
  • Atomic Density: 0.048626854293344145
  • Unit Cell Volume: 493.5544432962637
  • Molar Volume: 12.384393042723076
  • Full Formula: Zr16 Zn8
  • Reduced Formula: Zr2Zn
  • Formula Anonymous: AB2
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m