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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-92228
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Fe', 'H', 'O']
  • Chemical System: Fe-H-O
  • Density: 5.168388018284821
  • Atomic Density: 0.1401199803590327
  • Unit Cell Volume: 57.09392750057068
  • Molar Volume: 4.297845849370895
  • Full Formula: Fe2 H2 O4
  • Reduced Formula: FeHO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2