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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99987
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 4
  • Element list: ['Hf', 'Zr', 'C', 'N']
  • Chemical System: C-Hf-N-Zr
  • Density: 9.904701165307022
  • Atomic Density: 0.0806779457627128
  • Unit Cell Volume: 49.57984443189298
  • Molar Volume: 7.464420050694044
  • Full Formula: Hf1 Zr1 C1 N1
  • Reduced Formula: HfZrCN
  • Formula Anonymous: ABCD
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m