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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111034
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Li', 'Tl', 'In']
  • Chemical System: In-Li-Tl
  • Density: 4.565781062107219
  • Atomic Density: 0.054384574028203944
  • Unit Cell Volume: 128.71296916603202
  • Molar Volume: 11.073251685076926
  • Full Formula: Li5 Tl1 In1
  • Reduced Formula: Li5TlIn
  • Formula Anonymous: ABC5
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m