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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-41171
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Mg', 'Zr', 'Ir']
  • Chemical System: Ir-Mg-Zr
  • Density: 12.541979941086783
  • Atomic Density: 0.060428126593705944
  • Unit Cell Volume: 66.19434070651184
  • Molar Volume: 9.965790931250305
  • Full Formula: Mg1 Zr1 Ir2
  • Reduced Formula: MgZrIr2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m