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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1499577
  • 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', 'I', 'Pr', 'Sm']
  • Chemical System: Br-C-Cl-I-Pr-Sm
  • Density: 5.049679223342734
  • Atomic Density: 0.03193763267214374
  • Unit Cell Volume: 313.11024529135125
  • Molar Volume: 18.855939705426444
  • Full Formula: Pr2 Sm2 C1 I1 Br2 Cl2
  • Reduced Formula: Pr2Sm2CI(BrCl)2
  • Formula Anonymous: ABC2D2E2F2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m