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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1759386
  • 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: ['H', 'Na', 'V']
  • Chemical System: H-Na-V
  • Density: 2.6383658924018873
  • Atomic Density: 0.10323300859354125
  • Unit Cell Volume: 193.7364828603019
  • Molar Volume: 5.833541850660327
  • Full Formula: Na4 V4 H12
  • Reduced Formula: NaVH3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm