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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57195
  • 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: 7
  • Number of elements: 4
  • Element list: ['Ba', 'Mn', 'As', 'O']
  • Chemical System: As-Ba-Mn-O
  • Density: 5.680625681055954
  • Atomic Density: 0.04350991548582894
  • Unit Cell Volume: 160.8828682344805
  • Molar Volume: 13.840846834008204
  • Full Formula: Ba2 Mn2 As2 O1
  • Reduced Formula: Ba2Mn2As2O
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m