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-676791
  • Created at: Sept. 4, 2022, 3:52 p.m.
  • Last updated at: Sept. 4, 2022, 3:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 84
  • Number of elements: 4
  • Element list: ['H', 'O', 'S', 'Sr']
  • Chemical System: H-O-S-Sr
  • Density: 2.470626770840589
  • Atomic Density: 0.10780579215012366
  • Unit Cell Volume: 779.178913532093
  • Molar Volume: 5.586101302993016
  • Full Formula: Sr4 H40 S8 O32
  • Reduced Formula: SrH10(SO4)2
  • Formula Anonymous: AB2C8D10
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m