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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-19463
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Al', 'Cu']
  • Chemical System: Al-Cu
  • Density: 7.321870460824694
  • Atomic Density: 0.08104664652902649
  • Unit Cell Volume: 98.70858749392964
  • Molar Volume: 7.4304626013652495
  • Full Formula: Al2 Cu6
  • Reduced Formula: AlCu3
  • Formula Anonymous: AB3
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm