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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22668
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['K', 'Zn', 'As']
  • Chemical System: As-K-Zn
  • Density: 2.440623571627734
  • Atomic Density: 0.02768349907443164
  • Unit Cell Volume: 252.8582091873339
  • Molar Volume: 21.753538972109286
  • Full Formula: K4 Zn1 As2
  • Reduced Formula: K4ZnAs2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m