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-1723659
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['H', 'Pb', 'Pd']
  • Chemical System: H-Pb-Pd
  • Density: 8.12179755298645
  • Atomic Density: 0.08354953683374707
  • Unit Cell Volume: 107.72052534425
  • Molar Volume: 7.207868515158011
  • Full Formula: H6 Pd1 Pb2
  • Reduced Formula: H6PdPb2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m