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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-26131
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 25
  • Number of elements: 3
  • Element list: ['Bi', 'Cl', 'Pt']
  • Chemical System: Bi-Cl-Pt
  • Density: 7.105776642390359
  • Atomic Density: 0.03419764335745815
  • Unit Cell Volume: 731.04452662665
  • Molar Volume: 17.609812164693018
  • Full Formula: Bi12 Pt1 Cl12
  • Reduced Formula: Bi12PtCl12
  • Formula Anonymous: AB12C12
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1