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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-28430
  • 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: 6
  • Number of elements: 3
  • Element list: ['Cd', 'I', 'Br']
  • Chemical System: Br-Cd-I
  • Density: 5.376970218923871
  • Atomic Density: 0.03043129374146042
  • Unit Cell Volume: 197.16545904932846
  • Molar Volume: 19.789302456751194
  • Full Formula: Cd2 I2 Br2
  • Reduced Formula: CdIBr
  • Formula Anonymous: ABC
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m