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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119609
  • 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: 20
  • Number of elements: 3
  • Element list: ['Cr', 'B', 'Ir']
  • Chemical System: B-Cr-Ir
  • Density: 10.806404562755246
  • Atomic Density: 0.10237775493549374
  • Unit Cell Volume: 195.35493831254277
  • Molar Volume: 5.882274683396248
  • Full Formula: Cr8 B8 Ir4
  • Reduced Formula: Cr2B2Ir
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 58
  • Spacegroup Symbol: Pnnm
  • Crystal System: orthorhombic
  • Pointgroup: mmm