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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42387
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Mn', 'O', 'F']
  • Chemical System: F-Mn-O
  • Density: 4.227478071874335
  • Atomic Density: 0.08352940544261542
  • Unit Cell Volume: 143.6619827043302
  • Molar Volume: 7.209605680884684
  • Full Formula: Mn4 O2 F6
  • Reduced Formula: Mn2OF3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm