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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101581
  • 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: 4
  • Number of elements: 3
  • Element list: ['Li', 'Pr', 'Ir']
  • Chemical System: Ir-Li-Pr
  • Density: 8.459699959916602
  • Atomic Density: 0.04236867532030557
  • Unit Cell Volume: 94.40937130462902
  • Molar Volume: 14.213663076489519
  • Full Formula: Li1 Pr2 Ir1
  • Reduced Formula: LiPr2Ir
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m