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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-49789
  • 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: 14
  • Number of elements: 2
  • Element list: ['Zr', 'N']
  • Chemical System: N-Zr
  • Density: 5.675261840474075
  • Atomic Density: 0.0725633759222106
  • Unit Cell Volume: 192.93479419987685
  • Molar Volume: 8.299146344094929
  • Full Formula: Zr6 N8
  • Reduced Formula: Zr3N4
  • Formula Anonymous: A3B4
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m