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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14650
  • 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: 6
  • Number of elements: 2
  • Element list: ['Th', 'Ir']
  • Chemical System: Ir-Th
  • Density: 18.291177726836
  • Atomic Density: 0.05539347147070449
  • Unit Cell Volume: 108.31601343442021
  • Molar Volume: 10.87157132440216
  • Full Formula: Th1 Ir5
  • Reduced Formula: ThIr5
  • Formula Anonymous: AB5
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm