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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117774
  • 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: 3
  • Number of elements: 3
  • Element list: ['Cd', 'Sb', 'Br']
  • Chemical System: Br-Cd-Sb
  • Density: 5.9989906491940985
  • Atomic Density: 0.03450777628259678
  • Unit Cell Volume: 86.93692619981955
  • Molar Volume: 17.45154689390151
  • Full Formula: Cd1 Sb1 Br1
  • Reduced Formula: CdSbBr
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2