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-1350778
  • Created at: Sept. 4, 2022, 3:46 p.m.
  • Last updated at: Sept. 4, 2022, 3:46 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Ni', 'O', 'Sb', 'Sm']
  • Chemical System: Ni-O-Sb-Sm
  • Density: 6.8411960144850115
  • Atomic Density: 0.07319391692397978
  • Unit Cell Volume: 1092.9870044130732
  • Molar Volume: 8.227651986782835
  • Full Formula: Sm12 Ni8 Sb12 O48
  • Reduced Formula: Sm3Ni2(SbO4)3
  • Formula Anonymous: A2B3C3D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m