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-758397
  • Created at: Sept. 4, 2022, 3:24 p.m.
  • Last updated at: Sept. 4, 2022, 3:24 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Yb', 'Zr']
  • Chemical System: Yb-Zr
  • Density: 7.525929673876325
  • Atomic Density: 0.03824787998042677
  • Unit Cell Volume: 313.7428795044578
  • Molar Volume: 15.745031523529702
  • Full Formula: Yb4 Zr8
  • Reduced Formula: YbZr2
  • Formula Anonymous: AB2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm