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-17311
  • 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: 7
  • Number of elements: 2
  • Element list: ['Ti', 'Te']
  • Chemical System: Te-Ti
  • Density: 6.347114019189472
  • Atomic Density: 0.04091163444639415
  • Unit Cell Volume: 171.10047287824653
  • Molar Volume: 14.719873311076613
  • Full Formula: Ti3 Te4
  • Reduced Formula: Ti3Te4
  • Formula Anonymous: A3B4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m