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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42266
  • 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: 18
  • Number of elements: 3
  • Element list: ['Mn', 'O', 'F']
  • Chemical System: F-Mn-O
  • Density: 4.7840660194478675
  • Atomic Density: 0.09718312221088349
  • Unit Cell Volume: 185.21734628921183
  • Molar Volume: 6.196694058596098
  • Full Formula: Mn6 O8 F4
  • Reduced Formula: Mn3(O2F)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm