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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86259
  • 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: 16
  • Number of elements: 2
  • Element list: ['Ta', 'Ni']
  • Chemical System: Ni-Ta
  • Density: 11.97254930432946
  • Atomic Density: 0.08077838268813864
  • Unit Cell Volume: 198.07279457142948
  • Molar Volume: 7.4551390602232015
  • Full Formula: Ta4 Ni12
  • Reduced Formula: TaNi3
  • Formula Anonymous: AB3
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m