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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-756365
  • Created at: Sept. 4, 2022, 3:24 p.m.
  • Last updated at: Sept. 4, 2022, 3:24 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Be', 'Zr']
  • Chemical System: Be-Zr
  • Density: 5.641897290122379
  • Atomic Density: 0.053237648619263826
  • Unit Cell Volume: 225.40439540858776
  • Molar Volume: 11.311808308943442
  • Full Formula: Zr8 Be4
  • Reduced Formula: Zr2Be
  • Formula Anonymous: AB2
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm