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-1741340
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 4
  • Element list: ['Cu', 'H', 'Mg', 'Sr']
  • Chemical System: Cu-H-Mg-Sr
  • Density: 3.104098071844541
  • Atomic Density: 0.10792932274642915
  • Unit Cell Volume: 111.18387195102659
  • Molar Volume: 5.579707726090817
  • Full Formula: Sr1 Mg2 Cu1 H8
  • Reduced Formula: SrMg2CuH8
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1