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-90616
  • 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: 8
  • Number of elements: 3
  • Element list: ['Li', 'Pt', 'F']
  • Chemical System: F-Li-Pt
  • Density: 5.448660718090771
  • Atomic Density: 0.08306582480622107
  • Unit Cell Volume: 96.30916226574149
  • Molar Volume: 7.249841645524697
  • Full Formula: Li1 Pt1 F6
  • Reduced Formula: LiPtF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3