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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-748485
  • Created at: Sept. 4, 2022, 3:21 p.m.
  • Last updated at: Sept. 4, 2022, 3:21 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['Zn', 'Zr']
  • Chemical System: Zn-Zr
  • Density: 6.6523834117987075
  • Atomic Density: 0.051153446986503856
  • Unit Cell Volume: 78.19609890718304
  • Molar Volume: 11.772697862548462
  • Full Formula: Zr2 Zn2
  • Reduced Formula: ZrZn
  • Formula Anonymous: AB
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m