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-86166
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Zr', 'Te']
  • Chemical System: Te-Zr
  • Density: 7.295460225760715
  • Atomic Density: 0.04015490842292907
  • Unit Cell Volume: 199.22844589110997
  • Molar Volume: 14.997271806903848
  • Full Formula: Zr4 Te4
  • Reduced Formula: ZrTe
  • Formula Anonymous: AB
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm