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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98142
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 32
  • Number of elements: 4
  • Element list: ['P', 'C', 'S', 'N']
  • Chemical System: C-N-P-S
  • Density: 1.9077043393966018
  • Atomic Density: 0.057034076815882136
  • Unit Cell Volume: 561.0680804618379
  • Molar Volume: 10.558846739013104
  • Full Formula: P4 C8 S8 N12
  • Reduced Formula: PC2S2N3
  • Formula Anonymous: AB2C2D3
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1