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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-44571
  • 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: 56
  • Number of elements: 2
  • Element list: ['As', 'K']
  • Chemical System: As-K
  • Density: 3.416225964161727
  • Atomic Density: 0.03059400550093768
  • Unit Cell Volume: 1830.4239370775967
  • Molar Volume: 19.68405464206191
  • Full Formula: K12 As44
  • Reduced Formula: K3As11
  • Formula Anonymous: A3B11
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm