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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119507
  • 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: 25
  • Number of elements: 4
  • Element list: ['Ba', 'Y', 'Cu', 'O']
  • Chemical System: Ba-Cu-O-Y
  • Density: 6.095861514346254
  • Atomic Density: 0.06971755077957292
  • Unit Cell Volume: 358.5897628423995
  • Molar Volume: 8.63791210772779
  • Full Formula: Ba4 Y2 Cu6 O13
  • Reduced Formula: Ba4Y2Cu6O13
  • Formula Anonymous: A2B4C6D13
  • Spacegroup Number: 69
  • Spacegroup Symbol: Fmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm