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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112039
  • 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: 4
  • Element list: ['H', 'C', 'S', 'N']
  • Chemical System: C-H-N-S
  • Density: 1.8341896755054687
  • Atomic Density: 0.07749740748339834
  • Unit Cell Volume: 335.4950938916218
  • Molar Volume: 7.770764152710626
  • Full Formula: H6 C12 S6 N2
  • Reduced Formula: H3C6S3N
  • Formula Anonymous: AB3C3D6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2