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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23235
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 38
  • Number of elements: 4
  • Element list: ['Ba', 'Nd', 'Mn', 'O']
  • Chemical System: Ba-Mn-Nd-O
  • Density: 6.931105003716537
  • Atomic Density: 0.06619022726292599
  • Unit Cell Volume: 574.1028784967519
  • Molar Volume: 9.098232486917414
  • Full Formula: Ba5 Nd8 Mn4 O21
  • Reduced Formula: Ba5Nd8Mn4O21
  • Formula Anonymous: A4B5C8D21
  • Spacegroup Number: 87
  • Spacegroup Symbol: I4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m