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-5221
  • 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: 21
  • Number of elements: 2
  • Element list: ['W', 'Cl']
  • Chemical System: Cl-W
  • Density: 3.7089444799778244
  • Atomic Density: 0.039426893458256194
  • Unit Cell Volume: 532.6313629612756
  • Molar Volume: 15.274195433064058
  • Full Formula: W3 Cl18
  • Reduced Formula: WCl6
  • Formula Anonymous: AB6
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1