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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-2026
  • 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: 3
  • Number of elements: 2
  • Element list: ['Ni', 'Br']
  • Chemical System: Br-Ni
  • Density: 5.1681089693028115
  • Atomic Density: 0.042731643394846246
  • Unit Cell Volume: 70.20558447236837
  • Molar Volume: 14.092930394355754
  • Full Formula: Ni1 Br2
  • Reduced Formula: NiBr2
  • Formula Anonymous: AB2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m