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-28452
  • 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: 9
  • Number of elements: 2
  • Element list: ['W', 'S']
  • Chemical System: S-W
  • Density: 5.322844321998501
  • Atomic Density: 0.038780801421606524
  • Unit Cell Volume: 232.07359492539254
  • Molar Volume: 15.528665059110397
  • Full Formula: W3 S6
  • Reduced Formula: WS2
  • Formula Anonymous: AB2
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2