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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98167
  • 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: 30
  • Number of elements: 4
  • Element list: ['Fe', 'H', 'Cl', 'O']
  • Chemical System: Cl-Fe-H-O
  • Density: 2.0805290622440507
  • Atomic Density: 0.09453074746474946
  • Unit Cell Volume: 317.3570589948737
  • Molar Volume: 6.3705629348225115
  • Full Formula: Fe2 H16 Cl4 O8
  • Reduced Formula: FeH8(ClO2)2
  • Formula Anonymous: AB2C4D8
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m