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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1338884
  • Created at: Sept. 4, 2022, 3:45 p.m.
  • Last updated at: Sept. 4, 2022, 3:45 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 20
  • Number of elements: 2
  • Element list: ['Sn', 'Zr']
  • Chemical System: Sn-Zr
  • Density: 7.420410883157327
  • Atomic Density: 0.04148587470231993
  • Unit Cell Volume: 482.09179976339226
  • Molar Volume: 14.516123387084415
  • Full Formula: Zr8 Sn12
  • Reduced Formula: Zr2Sn3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm