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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34642
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Ba', 'Mn', 'F']
  • Chemical System: Ba-F-Mn
  • Density: 4.621289774727347
  • Atomic Density: 0.06224602274687349
  • Unit Cell Volume: 192.78340158050884
  • Molar Volume: 9.67473983757859
  • Full Formula: Ba2 Mn2 F8
  • Reduced Formula: BaMnF4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2