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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111820
  • 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: 16
  • Number of elements: 3
  • Element list: ['Cu', 'Bi', 'Ir']
  • Chemical System: Bi-Cu-Ir
  • Density: 11.60423140158262
  • Atomic Density: 0.03551876134511796
  • Unit Cell Volume: 450.4661591246395
  • Molar Volume: 16.95481636165711
  • Full Formula: Cu1 Bi12 Ir3
  • Reduced Formula: Cu(Bi4Ir)3
  • Formula Anonymous: AB3C12
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m