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-942491
  • Created at: Sept. 4, 2022, 3:49 p.m.
  • Last updated at: Sept. 4, 2022, 3:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Ac', 'Al', 'Fe']
  • Chemical System: Ac-Al-Fe
  • Density: 6.780112594726761
  • Atomic Density: 0.03953579245926188
  • Unit Cell Volume: 75.88060876966696
  • Molar Volume: 15.232123565514163
  • Full Formula: Ac1 Al1 Fe1
  • Reduced Formula: AcAlFe
  • Formula Anonymous: ABC
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m