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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103763
  • 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: 44
  • Number of elements: 3
  • Element list: ['H', 'C', 'S']
  • Chemical System: C-H-S
  • Density: 1.5392109064085326
  • Atomic Density: 0.09426949626755275
  • Unit Cell Volume: 466.7469514753804
  • Molar Volume: 6.38821782064916
  • Full Formula: H16 C24 S4
  • Reduced Formula: H4C6S
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm