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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109806
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ba', 'Na', 'N']
  • Chemical System: Ba-N-Na
  • Density: 4.1296931876738325
  • Atomic Density: 0.04279904556127243
  • Unit Cell Volume: 140.19004212162196
  • Molar Volume: 14.070736113445607
  • Full Formula: Ba2 Na2 N2
  • Reduced Formula: BaNaN
  • Formula Anonymous: ABC
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm