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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119229
  • 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: ['Ca', 'Co', 'N']
  • Chemical System: Ca-Co-N
  • Density: 4.428436082782996
  • Atomic Density: 0.07991872109981794
  • Unit Cell Volume: 275.27968037078756
  • Molar Volume: 7.535331743457689
  • Full Formula: Ca6 Co6 N10
  • Reduced Formula: Ca3Co3N5
  • Formula Anonymous: A3B3C5
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1