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-10704
  • 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: 11
  • Number of elements: 4
  • Element list: ['K', 'Sn', 'As', 'S']
  • Chemical System: As-K-S-Sn
  • Density: 3.1488377141257895
  • Atomic Density: 0.03868944260200563
  • Unit Cell Volume: 284.3152875877764
  • Molar Volume: 15.565333473395185
  • Full Formula: K2 Sn1 As2 S6
  • Reduced Formula: K2Sn(AsS3)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 147
  • Spacegroup Symbol: P-3
  • Crystal System: trigonal
  • Pointgroup: -3