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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100837
  • 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: 8
  • Number of elements: 3
  • Element list: ['Fe', 'Si', 'Ir']
  • Chemical System: Fe-Ir-Si
  • Density: 8.191398873322168
  • Atomic Density: 0.08359310993742569
  • Unit Cell Volume: 95.70166735019747
  • Molar Volume: 7.204111396869816
  • Full Formula: Fe3 Si4 Ir1
  • Reduced Formula: Fe3Si4Ir
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3