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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-9169
  • 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: 2
  • Element list: ['Ca', 'N']
  • Chemical System: Ca-N
  • Density: 2.230813295731137
  • Atomic Density: 0.07576640796088333
  • Unit Cell Volume: 184.77845758806356
  • Molar Volume: 7.948299150078636
  • Full Formula: Ca2 N12
  • Reduced Formula: CaN6
  • Formula Anonymous: AB6
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm