Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97395
  • 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: 36
  • Number of elements: 3
  • Element list: ['K', 'Sn', 'Sb']
  • Chemical System: K-Sb-Sn
  • Density: 3.2895838352960225
  • Atomic Density: 0.02623957122355413
  • Unit Cell Volume: 1371.9736383376705
  • Molar Volume: 22.950606580774398
  • Full Formula: K20 Sn4 Sb12
  • Reduced Formula: K5SnSb3
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m