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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107076
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ca', 'Cd', 'O']
  • Chemical System: Ca-Cd-O
  • Density: 6.755778531765452
  • Atomic Density: 0.07375201711589087
  • Unit Cell Volume: 108.47160949413941
  • Molar Volume: 8.16539126046825
  • Full Formula: Ca1 Cd3 O4
  • Reduced Formula: CaCd3O4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm