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-758341
  • Created at: Sept. 4, 2022, 3:22 p.m.
  • Last updated at: Sept. 4, 2022, 3:22 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 24
  • Number of elements: 2
  • Element list: ['W', 'Zr']
  • Chemical System: W-Zr
  • Density: 9.993269100467305
  • Atomic Density: 0.04928979917144699
  • Unit Cell Volume: 486.9161652803593
  • Molar Volume: 12.217823690157287
  • Full Formula: Zr16 W8
  • Reduced Formula: Zr2W
  • Formula Anonymous: AB2
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m