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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-297372
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['N', 'Ni']
  • Chemical System: N-Ni
  • Density: 0.21283693310197438
  • Atomic Density: 0.005090614348661235
  • Unit Cell Volume: 785.7597779042029
  • Molar Volume: 118.2988996521362
  • Full Formula: Ni1 N3
  • Reduced Formula: NiN3
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm