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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1281291
  • 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: 22
  • Number of elements: 2
  • Element list: ['O', 'Zr']
  • Chemical System: O-Zr
  • Density: 6.055969521608484
  • Atomic Density: 0.08412157852368043
  • Unit Cell Volume: 261.52623840513104
  • Molar Volume: 7.15885372776826
  • Full Formula: Zr8 O14
  • Reduced Formula: Zr4O7
  • Formula Anonymous: A4B7
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m