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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-17518
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['Ir', 'Ta']
  • Chemical System: Ir-Ta
  • Density: 20.824813216698548
  • Atomic Density: 0.06621443607995094
  • Unit Cell Volume: 60.40978730333339
  • Molar Volume: 9.094906060558362
  • Full Formula: Ta1 Ir3
  • Reduced Formula: TaIr3
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m