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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1477160
  • Created at: Sept. 4, 2022, 3:52 p.m.
  • Last updated at: Sept. 4, 2022, 3:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['F', 'Zn', 'Zr']
  • Chemical System: F-Zn-Zr
  • Density: 3.541858037884285
  • Atomic Density: 0.06305313184350639
  • Unit Cell Volume: 126.87712356390892
  • Molar Volume: 9.550898716572156
  • Full Formula: Zr1 Zn1 F6
  • Reduced Formula: ZrZnF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m