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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-757229
  • Created at: Sept. 4, 2022, 3:24 p.m.
  • Last updated at: Sept. 4, 2022, 3:24 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Mo', 'Zr']
  • Chemical System: Mo-Zr
  • Density: 7.485805932051866
  • Atomic Density: 0.0485803019962479
  • Unit Cell Volume: 247.0136970520854
  • Molar Volume: 12.39626044413046
  • Full Formula: Zr8 Mo4
  • Reduced Formula: Zr2Mo
  • Formula Anonymous: AB2
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm