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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-54936
  • 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: 26
  • Number of elements: 3
  • Element list: ['Ca', 'Si', 'N']
  • Chemical System: Ca-N-Si
  • Density: 3.037209500017703
  • Atomic Density: 0.06981083470330587
  • Unit Cell Volume: 372.4350254584304
  • Molar Volume: 8.626369797172504
  • Full Formula: Ca10 Si4 N12
  • Reduced Formula: Ca5(SiN3)2
  • Formula Anonymous: A2B5C6
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m