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-33871
  • 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: 20
  • Number of elements: 3
  • Element list: ['Te', 'Rh', 'Cl']
  • Chemical System: Cl-Rh-Te
  • Density: 5.462793950401801
  • Atomic Density: 0.033745935074633304
  • Unit Cell Volume: 592.6639743651356
  • Molar Volume: 17.84552938503939
  • Full Formula: Te12 Rh2 Cl6
  • Reduced Formula: Te6RhCl3
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m