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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1742595
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['As', 'K', 'Pt']
  • Chemical System: As-K-Pt
  • Density: 6.337808554463187
  • Atomic Density: 0.03704305436272322
  • Unit Cell Volume: 161.97368449287103
  • Molar Volume: 16.25713879053164
  • Full Formula: K2 As2 Pt2
  • Reduced Formula: KAsPt
  • Formula Anonymous: ABC
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm