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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1281552
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Cu', 'O', 'Sc']
  • Chemical System: Cu-O-Sc
  • Density: 11.984284048547183
  • Atomic Density: 0.2054681273732323
  • Unit Cell Volume: 38.93547920193004
  • Molar Volume: 2.9309367039009397
  • Full Formula: Sc2 Cu2 O4
  • Reduced Formula: ScCuO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm