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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-87053
  • 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: 14
  • Number of elements: 3
  • Element list: ['Sc', 'Si', 'Ni']
  • Chemical System: Ni-Sc-Si
  • Density: 3.9059585409294173
  • Atomic Density: 0.059267520730868814
  • Unit Cell Volume: 236.21706842729898
  • Molar Volume: 10.160945971312474
  • Full Formula: Sc6 Si6 Ni2
  • Reduced Formula: Sc3Si3Ni
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m