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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1281032
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Fe', 'H']
  • Chemical System: Fe-H
  • Density: 7.670434302860543
  • Atomic Density: 0.23950086005322652
  • Unit Cell Volume: 50.104204207588765
  • Molar Volume: 2.514454753382365
  • Full Formula: Fe4 H8
  • Reduced Formula: FeH2
  • Formula Anonymous: AB2
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3