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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10760
  • 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: 11
  • Number of elements: 4
  • Element list: ['Tl', 'Cd', 'N', 'O']
  • Chemical System: Cd-N-O-Tl
  • Density: 4.849708219896693
  • Atomic Density: 0.07063637915098704
  • Unit Cell Volume: 155.72712152313503
  • Molar Volume: 8.52555132692677
  • Full Formula: Tl1 Cd1 N3 O6
  • Reduced Formula: TlCd(NO2)3
  • Formula Anonymous: ABC3D6
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3