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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103192
  • 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: 10
  • Number of elements: 3
  • Element list: ['Na', 'Tl', 'I']
  • Chemical System: I-Na-Tl
  • Density: 3.941577632719215
  • Atomic Density: 0.022938932385284945
  • Unit Cell Volume: 435.94007916492586
  • Molar Volume: 26.25292519656727
  • Full Formula: Na3 Tl1 I6
  • Reduced Formula: Na3TlI6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m