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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102642
  • 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: 4
  • Number of elements: 4
  • Element list: ['Zr', 'Nb', 'C', 'N']
  • Chemical System: C-N-Nb-Zr
  • Density: 7.328296740226417
  • Atomic Density: 0.08400190478518256
  • Unit Cell Volume: 47.61796783333866
  • Molar Volume: 7.16905262493794
  • Full Formula: Zr1 Nb1 C1 N1
  • Reduced Formula: ZrNbCN
  • Formula Anonymous: ABCD
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m