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-108098
  • 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: 10
  • Number of elements: 4
  • Element list: ['Na', 'Ti', 'Te', 'O']
  • Chemical System: Na-O-Te-Ti
  • Density: 4.189363957140768
  • Atomic Density: 0.07947551004894178
  • Unit Cell Volume: 125.82492385191242
  • Molar Volume: 7.577354025524979
  • Full Formula: Na2 Ti1 Te1 O6
  • Reduced Formula: Na2TiTeO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3