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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97403
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['Li', 'Sc', 'N']
  • Chemical System: Li-N-Sc
  • Density: 2.4936290524858067
  • Atomic Density: 0.09606534805849229
  • Unit Cell Volume: 499.6598770534173
  • Molar Volume: 6.268796066124944
  • Full Formula: Li24 Sc8 N16
  • Reduced Formula: Li3ScN2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 206
  • Spacegroup Symbol: Ia-3
  • Crystal System: cubic
  • Pointgroup: m-3