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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8692
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Cs', 'Pd', 'I']
  • Chemical System: Cs-I-Pd
  • Density: 5.176591789222405
  • Atomic Density: 0.024748870308254876
  • Unit Cell Volume: 363.65296225250694
  • Molar Volume: 24.33299251639515
  • Full Formula: Cs2 Pd1 I6
  • Reduced Formula: Cs2PdI6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm