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-1218655
  • Created at: Sept. 4, 2022, 3:39 p.m.
  • Last updated at: Sept. 4, 2022, 3:39 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 2
  • Number of elements: 2
  • Element list: ['Ba', 'Rb']
  • Chemical System: Ba-Rb
  • Density: 1.3739063391479511
  • Atomic Density: 0.007427334361721663
  • Unit Cell Volume: 269.27561122162786
  • Molar Volume: 81.08078170058393
  • Full Formula: Rb1 Ba1
  • Reduced Formula: RbBa
  • Formula Anonymous: AB
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m