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-675434
  • Created at: Sept. 4, 2022, 3:16 p.m.
  • Last updated at: Sept. 4, 2022, 3:16 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Al', 'Li', 'Mo', 'O']
  • Chemical System: Al-Li-Mo-O
  • Density: 4.351995126956339
  • Atomic Density: 0.10793305663100118
  • Unit Cell Volume: 741.2001707086087
  • Molar Volume: 5.579514699179088
  • Full Formula: Li12 Al12 Mo8 O48
  • Reduced Formula: Li3Al3(MoO6)2
  • Formula Anonymous: A2B3C3D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m