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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1467901
  • 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: 12
  • Number of elements: 3
  • Element list: ['Ge', 'Zn', 'Zr']
  • Chemical System: Ge-Zn-Zr
  • Density: 7.302126718736888
  • Atomic Density: 0.057539834558958655
  • Unit Cell Volume: 208.55117314777996
  • Molar Volume: 10.46603766965886
  • Full Formula: Zr4 Zn4 Ge4
  • Reduced Formula: ZrZnGe
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm