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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-38910
  • 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: 4
  • Number of elements: 3
  • Element list: ['Pr', 'Ir', 'Au']
  • Chemical System: Au-Ir-Pr
  • Density: 11.497244234877781
  • Atomic Density: 0.041274599023778495
  • Unit Cell Volume: 96.91190452742087
  • Molar Volume: 14.590428259595246
  • Full Formula: Pr2 Ir1 Au1
  • Reduced Formula: Pr2IrAu
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m