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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-984383
  • Created at: Sept. 4, 2022, 3:43 p.m.
  • Last updated at: Sept. 4, 2022, 3:43 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Hf', 'Ta', 'Tc']
  • Chemical System: Hf-Ta-Tc
  • Density: 21.93527699817536
  • Atomic Density: 0.08085521214281857
  • Unit Cell Volume: 61.838932426127975
  • Molar Volume: 7.448055110365419
  • Full Formula: Hf2 Ta2 Tc1
  • Reduced Formula: Hf2Ta2Tc
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m