Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: oqmd-16123
  • Created at: Sept. 4, 2022, 3:18 p.m.
  • Last updated at: Sept. 4, 2022, 3:18 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['I', 'Pd', 'Rb']
  • Chemical System: I-Pd-Rb
  • Density: 4.6262681496618345
  • Atomic Density: 0.024137907725042686
  • Unit Cell Volume: 1491.430011667937
  • Molar Volume: 24.94889295542433
  • Full Formula: Rb8 Pd4 I24
  • Reduced Formula: Rb2PdI6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm