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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1339145
  • Created at: Sept. 4, 2022, 3:45 p.m.
  • Last updated at: Sept. 4, 2022, 3:45 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 56
  • Number of elements: 2
  • Element list: ['Al', 'Cu']
  • Chemical System: Al-Cu
  • Density: 4.938438467523947
  • Atomic Density: 0.06972699103564516
  • Unit Cell Volume: 803.1323188945903
  • Molar Volume: 8.636742630872197
  • Full Formula: Al32 Cu24
  • Reduced Formula: Al4Cu3
  • Formula Anonymous: A3B4
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m