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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-756973
  • 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: ['In', 'Zr']
  • Chemical System: In-Zr
  • Density: 6.232632588344599
  • Atomic Density: 0.03787899467010541
  • Unit Cell Volume: 316.7982705061218
  • Molar Volume: 15.898364812603518
  • Full Formula: Zr8 In4
  • Reduced Formula: Zr2In
  • Formula Anonymous: AB2
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm