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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104981
  • 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: 8
  • Number of elements: 3
  • Element list: ['Zr', 'B', 'N']
  • Chemical System: B-N-Zr
  • Density: 6.839898677660353
  • Atomic Density: 0.07888563157189118
  • Unit Cell Volume: 101.41263802533324
  • Molar Volume: 7.634014762893566
  • Full Formula: Zr4 B1 N3
  • Reduced Formula: Zr4BN3
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m