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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1759378
  • 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: 20
  • Number of elements: 3
  • Element list: ['Fe', 'H', 'Na']
  • Chemical System: Fe-H-Na
  • Density: 3.4395852996516108
  • Atomic Density: 0.1265210347495435
  • Unit Cell Volume: 158.07648142928394
  • Molar Volume: 4.759794110063369
  • Full Formula: Na4 Fe4 H12
  • Reduced Formula: NaFeH3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m