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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-5824
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Ta', 'S', 'Br']
  • Chemical System: Br-S-Ta
  • Density: 6.7553028414865635
  • Atomic Density: 0.03945342751589345
  • Unit Cell Volume: 278.8097433504035
  • Molar Volume: 15.26392290650549
  • Full Formula: Ta3 S1 Br7
  • Reduced Formula: Ta3SBr7
  • Formula Anonymous: AB3C7
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m