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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22085
  • 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: ['Ca', 'Mn', 'N']
  • Chemical System: Ca-Mn-N
  • Density: 3.4207534729049036
  • Atomic Density: 0.06639365916455141
  • Unit Cell Volume: 210.86350980147236
  • Molar Volume: 9.070355265515044
  • Full Formula: Ca6 Mn2 N6
  • Reduced Formula: Ca3MnN3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm