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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112757
  • 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: 4.791926594328958
  • Atomic Density: 0.09734280128015456
  • Unit Cell Volume: 184.9135196776969
  • Molar Volume: 6.186529132922892
  • Full Formula: Mn6 O8 F4
  • Reduced Formula: Mn3(O2F)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 113
  • Spacegroup Symbol: P-42_1m
  • Crystal System: tetragonal
  • Pointgroup: -42m