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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104101
  • 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: 64
  • Number of elements: 3
  • Element list: ['H', 'C', 'S']
  • Chemical System: C-H-S
  • Density: 1.3005596628660363
  • Atomic Density: 0.12261940191356638
  • Unit Cell Volume: 521.940239482763
  • Molar Volume: 4.911246235114544
  • Full Formula: H40 C20 S4
  • Reduced Formula: H10C5S
  • Formula Anonymous: AB5C10
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m