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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-39444
  • 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: 4
  • Number of elements: 2
  • Element list: ['S', 'Br']
  • Chemical System: Br-S
  • Density: 4.224555548485492
  • Atomic Density: 0.037443739786973074
  • Unit Cell Volume: 106.82693616495077
  • Molar Volume: 16.083171163621703
  • Full Formula: S1 Br3
  • Reduced Formula: SBr3
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm