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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1238691
  • Created at: Sept. 4, 2022, 3:40 p.m.
  • Last updated at: Sept. 4, 2022, 3:40 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Ta', 'Tl']
  • Chemical System: Ta-Tl
  • Density: 3.904897049774819
  • Atomic Density: 0.012458083667359655
  • Unit Cell Volume: 481.6150027728646
  • Molar Volume: 48.33922231376635
  • Full Formula: Ta4 Tl2
  • Reduced Formula: Ta2Tl
  • Formula Anonymous: AB2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m