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-1499880
  • Created at: Sept. 4, 2022, 3:53 p.m.
  • Last updated at: Sept. 4, 2022, 3:53 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 6
  • Element list: ['Br', 'C', 'Cl', 'Dy', 'I', 'Sm']
  • Chemical System: Br-C-Cl-Dy-I-Sm
  • Density: 6.340111891620502
  • Atomic Density: 0.03513160082302039
  • Unit Cell Volume: 284.6440175150625
  • Molar Volume: 17.141663399676116
  • Full Formula: Sm2 Dy2 C1 I2 Br2 Cl1
  • Reduced Formula: Sm2Dy2CI2Br2Cl
  • Formula Anonymous: ABC2D2E2F2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m