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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-44360
  • 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: 14
  • Number of elements: 4
  • Element list: ['Li', 'Nb', 'Ni', 'O']
  • Chemical System: Li-Nb-Ni-O
  • Density: 4.713079655425794
  • Atomic Density: 0.08927889371492886
  • Unit Cell Volume: 156.81197892866558
  • Molar Volume: 6.745312928304131
  • Full Formula: Li2 Nb2 Ni2 O8
  • Reduced Formula: LiNbNiO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm