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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105346
  • 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: 6
  • Number of elements: 3
  • Element list: ['Y', 'Zr', 'Fe']
  • Chemical System: Fe-Y-Zr
  • Density: 7.493208886470606
  • Atomic Density: 0.06709896971387906
  • Unit Cell Volume: 89.42015094397094
  • Molar Volume: 8.975012262750663
  • Full Formula: Y1 Zr1 Fe4
  • Reduced Formula: YZrFe4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m