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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22400
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ba', 'Mn', 'N']
  • Chemical System: Ba-Mn-N
  • Density: 5.301885796471696
  • Atomic Density: 0.043915057466412416
  • Unit Cell Volume: 318.79726015860575
  • Molar Volume: 13.713156961267597
  • Full Formula: Ba6 Mn2 N6
  • Reduced Formula: Ba3MnN3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m