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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16883
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Zr', 'Sb', 'Pt']
  • Chemical System: Pt-Sb-Zr
  • Density: 8.221594841316618
  • Atomic Density: 0.04519552885232063
  • Unit Cell Volume: 199.1347424964999
  • Molar Volume: 13.32463832800307
  • Full Formula: Zr6 Sb2 Pt1
  • Reduced Formula: Zr6Sb2Pt
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m