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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51143
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['K', 'Zr', 'Nb']
  • Chemical System: K-Nb-Zr
  • Density: 5.59929896416653
  • Atomic Density: 0.04289327924466838
  • Unit Cell Volume: 93.25470261164978
  • Molar Volume: 14.039823641482364
  • Full Formula: K1 Zr2 Nb1
  • Reduced Formula: KZr2Nb
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m