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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119511
  • 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: 22
  • Number of elements: 3
  • Element list: ['Mn', 'C', 'N']
  • Chemical System: C-Mn-N
  • Density: 3.4434800329913275
  • Atomic Density: 0.09919979703749383
  • Unit Cell Volume: 221.77464729776432
  • Molar Volume: 6.070718831938594
  • Full Formula: Mn4 C6 N12
  • Reduced Formula: Mn2(CN2)3
  • Formula Anonymous: A2B3C6
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m