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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-46693
  • 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: 13
  • Number of elements: 3
  • Element list: ['Mn', 'O', 'F']
  • Chemical System: F-Mn-O
  • Density: 3.9191529994603673
  • Atomic Density: 0.07345854708132625
  • Unit Cell Volume: 176.97055708994145
  • Molar Volume: 8.198012347471103
  • Full Formula: Mn5 O3 F5
  • Reduced Formula: Mn5O3F5
  • Formula Anonymous: A3B5C5
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m