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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99569
  • 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: 4
  • Number of elements: 2
  • Element list: ['Ni', 'Ir']
  • Chemical System: Ir-Ni
  • Density: 19.129197701818125
  • Atomic Density: 0.07252678781840367
  • Unit Cell Volume: 55.15203582454813
  • Molar Volume: 8.303333073399788
  • Full Formula: Ni1 Ir3
  • Reduced Formula: NiIr3
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm