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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117156
  • 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: 28
  • Number of elements: 4
  • Element list: ['Mn', 'Tl', 'O', 'F']
  • Chemical System: F-Mn-O-Tl
  • Density: 5.870262475716664
  • Atomic Density: 0.07043857533280128
  • Unit Cell Volume: 397.50945937944294
  • Molar Volume: 8.549492563623243
  • Full Formula: Mn4 Tl4 O4 F16
  • Reduced Formula: MnTlOF4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m