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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-38045
  • 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: ['B', 'C', 'N']
  • Chemical System: B-C-N
  • Density: 1.9623615684047018
  • Atomic Density: 0.09174242965408305
  • Unit Cell Volume: 119.90090126755693
  • Molar Volume: 6.564182769855367
  • Full Formula: B2 C3 N6
  • Reduced Formula: B2(CN2)3
  • Formula Anonymous: A2B3C6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m