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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-47326
  • 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: 4.5869033273466515
  • Atomic Density: 0.08851675897069038
  • Unit Cell Volume: 146.86484402693227
  • Molar Volume: 6.803390487889473
  • Full Formula: Mn5 O7 F1
  • Reduced Formula: Mn5O7F
  • Formula Anonymous: AB5C7
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m