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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3486
  • 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: 7
  • Number of elements: 3
  • Element list: ['Cd', 'In', 'Te']
  • Chemical System: Cd-In-Te
  • Density: 5.598514796608693
  • Atomic Density: 0.027685628449205715
  • Unit Cell Volume: 252.83876119491975
  • Molar Volume: 21.75186584999761
  • Full Formula: Cd1 In2 Te4
  • Reduced Formula: Cd(InTe2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 82
  • Spacegroup Symbol: I-4
  • Crystal System: tetragonal
  • Pointgroup: -4