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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21466
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 22
  • Number of elements: 2
  • Element list: ['Nb', 'N']
  • Chemical System: N-Nb
  • Density: 7.216178984233283
  • Atomic Density: 0.08713992229675341
  • Unit Cell Volume: 252.4675191364
  • Molar Volume: 6.910886079851793
  • Full Formula: Nb10 N12
  • Reduced Formula: Nb5N6
  • Formula Anonymous: A5B6
  • Spacegroup Number: 193
  • Spacegroup Symbol: P6_3/mcm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm