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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-758418
  • Created at: Sept. 4, 2022, 3:26 p.m.
  • Last updated at: Sept. 4, 2022, 3:26 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 16
  • Number of elements: 2
  • Element list: ['Zn', 'Zr']
  • Chemical System: Zn-Zr
  • Density: 7.0057605813529875
  • Atomic Density: 0.05387073779643749
  • Unit Cell Volume: 297.00725578438414
  • Molar Volume: 11.178871881718033
  • Full Formula: Zr8 Zn8
  • Reduced Formula: ZrZn
  • Formula Anonymous: AB
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm