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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21456
  • 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: 11
  • Number of elements: 3
  • Element list: ['Li', 'Ni', 'N']
  • Chemical System: Li-N-Ni
  • Density: 3.343304388069352
  • Atomic Density: 0.08760589512554066
  • Unit Cell Volume: 125.56232641920755
  • Molar Volume: 6.874127307723042
  • Full Formula: Li5 Ni3 N3
  • Reduced Formula: Li5(NiN)3
  • Formula Anonymous: A3B3C5
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m