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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29453
  • 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: 24
  • Number of elements: 4
  • Element list: ['In', 'Te', 'Cl', 'O']
  • Chemical System: Cl-In-O-Te
  • Density: 5.351113342605538
  • Atomic Density: 0.05933391271655188
  • Unit Cell Volume: 404.49043221963217
  • Molar Volume: 10.149576328749434
  • Full Formula: In4 Te4 Cl4 O12
  • Reduced Formula: InTeClO3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m