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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-17142
  • 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: 4
  • Number of elements: 3
  • Element list: ['Cu', 'Ga', 'Sc']
  • Chemical System: Cu-Ga-Sc
  • Density: 6.799263437053186
  • Atomic Density: 0.06774366884367924
  • Unit Cell Volume: 59.04610819396469
  • Molar Volume: 8.889599371856118
  • Full Formula: Sc1 Ga1 Cu2
  • Reduced Formula: ScGaCu2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m