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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-511655
  • Created at: Sept. 4, 2022, 3:09 p.m.
  • Last updated at: Sept. 4, 2022, 3:09 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ac', 'Al', 'Ir']
  • Chemical System: Ac-Al-Ir
  • Density: 9.5744084624382
  • Atomic Density: 0.048741219888759534
  • Unit Cell Volume: 82.06606254683545
  • Molar Volume: 12.35533450690018
  • Full Formula: Ac1 Al2 Ir1
  • Reduced Formula: AcAl2Ir
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m