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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117344
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['K', 'Sb', 'S']
  • Chemical System: K-S-Sb
  • Density: 2.6738519082186487
  • Atomic Density: 0.033621542609785546
  • Unit Cell Volume: 832.7993847566829
  • Molar Volume: 17.91155399945051
  • Full Formula: K12 Sb4 S12
  • Reduced Formula: K3SbS3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23