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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101824
  • 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: 14
  • Number of elements: 3
  • Element list: ['H', 'C', 'S']
  • Chemical System: C-H-S
  • Density: 1.7626919226935236
  • Atomic Density: 0.08063546703866553
  • Unit Cell Volume: 173.6208707427323
  • Molar Volume: 7.4683523034749975
  • Full Formula: H4 C7 S3
  • Reduced Formula: H4C7S3
  • Formula Anonymous: A3B4C7
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2