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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116589
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Ta', 'Si', 'Ni']
  • Chemical System: Ni-Si-Ta
  • Density: 10.94878494299336
  • Atomic Density: 0.07388329710661784
  • Unit Cell Volume: 162.41830657182652
  • Molar Volume: 8.150882534803104
  • Full Formula: Ta4 Si4 Ni4
  • Reduced Formula: TaSiNi
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm