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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-645003
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['As', 'Cs', 'Ga']
  • Chemical System: As-Cs-Ga
  • Density: 4.081287992028172
  • Atomic Density: 0.023851318998406996
  • Unit Cell Volume: 2012.4673190277597
  • Molar Volume: 25.24866972934374
  • Full Formula: Cs24 Ga8 As16
  • Reduced Formula: Cs3GaAs2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m