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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-691904
  • Created at: Sept. 4, 2022, 3:17 p.m.
  • Last updated at: Sept. 4, 2022, 3:17 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 19
  • Number of elements: 3
  • Element list: ['Ba', 'O', 'Pd']
  • Chemical System: Ba-O-Pd
  • Density: 6.993517337635838
  • Atomic Density: 0.06952353624104253
  • Unit Cell Volume: 273.2887454706819
  • Molar Volume: 8.662017333411887
  • Full Formula: Ba4 Pd4 O11
  • Reduced Formula: Ba4Pd4O11
  • Formula Anonymous: A4B4C11
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1