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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16327
  • 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: 8
  • Number of elements: 2
  • Element list: ['Ba', 'N']
  • Chemical System: Ba-N
  • Density: 4.012819312399506
  • Atomic Density: 0.022691512221660305
  • Unit Cell Volume: 352.5547315600922
  • Molar Volume: 26.539177738236123
  • Full Formula: Ba6 N2
  • Reduced Formula: Ba3N
  • Formula Anonymous: AB3
  • Spacegroup Number: 193
  • Spacegroup Symbol: P6_3/mcm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm