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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-25694
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 4
  • Element list: ['Cl', 'Cs', 'I', 'Pd']
  • Chemical System: Cl-Cs-I-Pd
  • Density: 4.173989270126777
  • Atomic Density: 0.0294623448707902
  • Unit Cell Volume: 305.4746673922365
  • Molar Volume: 20.440127173891447
  • Full Formula: Cs2 Pd1 I2 Cl4
  • Reduced Formula: Cs2Pd(ICl2)2
  • Formula Anonymous: AB2C2D4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm