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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112341
  • 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: 12
  • Number of elements: 3
  • Element list: ['Tl', 'Pd', 'Pb']
  • Chemical System: Pb-Pd-Tl
  • Density: 12.75346689079654
  • Atomic Density: 0.0585633083401746
  • Unit Cell Volume: 204.9064566212009
  • Molar Volume: 10.283129370047549
  • Full Formula: Tl2 Pd9 Pb1
  • Reduced Formula: Tl2Pd9Pb
  • Formula Anonymous: AB2C9
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm