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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109705
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Mo', 'H', 'O']
  • Chemical System: H-Mo-O
  • Density: 4.276918556383346
  • Atomic Density: 0.08884750423328726
  • Unit Cell Volume: 112.55240185186247
  • Molar Volume: 6.778064068280005
  • Full Formula: Mo2 H2 O6
  • Reduced Formula: MoHO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2