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-107131
  • 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: 10
  • Number of elements: 4
  • Element list: ['Rb', 'Tl', 'Au', 'I']
  • Chemical System: Au-I-Rb-Tl
  • Density: 5.188987775505634
  • Atomic Density: 0.02342995191282453
  • Unit Cell Volume: 426.80411966728957
  • Molar Volume: 25.702744855843022
  • Full Formula: Rb2 Tl1 Au1 I6
  • Reduced Formula: Rb2TlAuI6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m