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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-54886
  • 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: 18
  • Number of elements: 3
  • Element list: ['Ca', 'Ga', 'N']
  • Chemical System: Ca-Ga-N
  • Density: 4.211304399429108
  • Atomic Density: 0.07229797108203002
  • Unit Cell Volume: 248.96964230956098
  • Molar Volume: 8.3296123941946
  • Full Formula: Ca6 Ga4 N8
  • Reduced Formula: Ca3(GaN2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m