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-24892
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Cl', 'H', 'O', 'Sr']
  • Chemical System: Cl-H-O-Sr
  • Density: 3.1708029482238183
  • Atomic Density: 0.05452591472301011
  • Unit Cell Volume: 146.71922590642893
  • Molar Volume: 11.044547882584421
  • Full Formula: Sr2 H2 Cl2 O2
  • Reduced Formula: SrHClO
  • Formula Anonymous: ABCD
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm