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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-114169
  • 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: 2
  • Number of elements: 2
  • Element list: ['Ca', 'N']
  • Chemical System: Ca-N
  • Density: 1.8050594718154214
  • Atomic Density: 0.04019740230860214
  • Unit Cell Volume: 49.75445887387617
  • Molar Volume: 14.98141773880567
  • Full Formula: Ca1 N1
  • Reduced Formula: CaN
  • Formula Anonymous: AB
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2