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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97461
  • 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: 36
  • Number of elements: 3
  • Element list: ['Mn', 'I', 'O']
  • Chemical System: I-Mn-O
  • Density: 5.077372943410835
  • Atomic Density: 0.06799120166008886
  • Unit Cell Volume: 529.480272756117
  • Molar Volume: 8.857235367168137
  • Full Formula: Mn4 I8 O24
  • Reduced Formula: Mn(IO3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2