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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111612
  • 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: 13
  • Number of elements: 3
  • Element list: ['Zr', 'Ga', 'Fe']
  • Chemical System: Fe-Ga-Zr
  • Density: 7.846384668030309
  • Atomic Density: 0.072727108169721
  • Unit Cell Volume: 178.75040445252273
  • Molar Volume: 8.280462280923253
  • Full Formula: Zr1 Ga6 Fe6
  • Reduced Formula: Zr(GaFe)6
  • Formula Anonymous: AB6C6
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm