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-797081
  • 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: 4
  • Number of elements: 4
  • Element list: ['Au', 'Cu', 'Zn', 'Zr']
  • Chemical System: Au-Cu-Zn-Zr
  • Density: 10.372621835690094
  • Atomic Density: 0.05989792859706683
  • Unit Cell Volume: 66.78027260187889
  • Molar Volume: 10.054005039992152
  • Full Formula: Zr1 Zn1 Cu1 Au1
  • Reduced Formula: ZrZnCuAu
  • Formula Anonymous: ABCD
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m