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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-33364
  • 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: 28
  • Number of elements: 4
  • Element list: ['H', 'S', 'N', 'O']
  • Chemical System: H-N-O-S
  • Density: 1.8969980904222215
  • Atomic Density: 0.12196593174802287
  • Unit Cell Volume: 229.5723043205784
  • Molar Volume: 4.93755975434314
  • Full Formula: H14 S2 N4 O8
  • Reduced Formula: H7S(NO2)2
  • Formula Anonymous: AB2C4D7
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1