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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101840
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 30
  • Number of elements: 4
  • Element list: ['H', 'C', 'S', 'O']
  • Chemical System: C-H-O-S
  • Density: 1.6500195342638766
  • Atomic Density: 0.09078371016065974
  • Unit Cell Volume: 330.45576069659484
  • Molar Volume: 6.633503686225899
  • Full Formula: H8 C16 S2 O4
  • Reduced Formula: H4C8SO2
  • Formula Anonymous: AB2C4D8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1