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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10187
  • 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: 16
  • Number of elements: 3
  • Element list: ['Ba', 'Cd', 'O']
  • Chemical System: Ba-Cd-O
  • Density: 6.717592919792084
  • Atomic Density: 0.057435578377191
  • Unit Cell Volume: 278.5729760554474
  • Molar Volume: 10.485035460862585
  • Full Formula: Ba4 Cd4 O8
  • Reduced Formula: BaCdO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm