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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1350804
  • Created at: Sept. 4, 2022, 3:46 p.m.
  • Last updated at: Sept. 4, 2022, 3:46 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['As', 'F', 'K', 'Na']
  • Chemical System: As-F-K-Na
  • Density: 3.201670632581319
  • Atomic Density: 0.06836132946128666
  • Unit Cell Volume: 1170.252255630932
  • Molar Volume: 8.80927976014622
  • Full Formula: K12 Na12 As8 F48
  • Reduced Formula: K3Na3As2F12
  • Formula Anonymous: A2B3C3D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m