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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-37694
  • 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: 8
  • Number of elements: 2
  • Element list: ['Tl', 'Br']
  • Chemical System: Br-Tl
  • Density: 9.026025399667088
  • Atomic Density: 0.03137187193025808
  • Unit Cell Volume: 255.00550358565064
  • Molar Volume: 19.19598796459341
  • Full Formula: Tl6 Br2
  • Reduced Formula: Tl3Br
  • Formula Anonymous: AB3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm