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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101854
  • 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: 16
  • Number of elements: 5
  • Element list: ['H', 'C', 'S', 'N', 'O']
  • Chemical System: C-H-N-O-S
  • Density: 1.9693969545015626
  • Atomic Density: 0.07233013977342088
  • Unit Cell Volume: 221.20792314408757
  • Molar Volume: 8.325907815005982
  • Full Formula: H2 C6 S4 N2 O2
  • Reduced Formula: HC3S2NO
  • Formula Anonymous: ABCD2E3
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1