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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1457682
  • Created at: Sept. 4, 2022, 3:51 p.m.
  • Last updated at: Sept. 4, 2022, 3:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['B', 'Zn', 'Zr']
  • Chemical System: B-Zn-Zr
  • Density: 5.5433773054269215
  • Atomic Density: 0.10021062482608868
  • Unit Cell Volume: 59.873890721794695
  • Molar Volume: 6.009483296258428
  • Full Formula: Zr1 Zn1 B4
  • Reduced Formula: ZrZnB4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm