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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1367448
  • Created at: Sept. 4, 2022, 3:48 p.m.
  • Last updated at: Sept. 4, 2022, 3:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Rh', 'Te', 'Zr']
  • Chemical System: Rh-Te-Zr
  • Density: 7.670583482399221
  • Atomic Density: 0.0459153162185989
  • Unit Cell Volume: 196.01302443724373
  • Molar Volume: 13.115755821715574
  • Full Formula: Zr6 Te2 Rh1
  • Reduced Formula: Zr6Te2Rh
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m