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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8683
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ba', 'Pd', 'O']
  • Chemical System: Ba-O-Pd
  • Density: 6.631785812349705
  • Atomic Density: 0.055847311010980116
  • Unit Cell Volume: 107.43579039678997
  • Molar Volume: 10.783224207188757
  • Full Formula: Ba2 Pd1 O3
  • Reduced Formula: Ba2PdO3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm