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-37075
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Sm', 'Tl', 'Te']
  • Chemical System: Sm-Te-Tl
  • Density: 7.109707642652478
  • Atomic Density: 0.02807845267013979
  • Unit Cell Volume: 142.45799250376163
  • Molar Volume: 21.447552081116935
  • Full Formula: Sm1 Tl1 Te2
  • Reduced Formula: SmTlTe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m