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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-11147
  • 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: 12
  • Number of elements: 3
  • Element list: ['Tl', 'Cu', 'S']
  • Chemical System: Cu-S-Tl
  • Density: 6.9000452544310455
  • Atomic Density: 0.05429980547185246
  • Unit Cell Volume: 220.9952668471432
  • Molar Volume: 11.090538368727149
  • Full Formula: Tl2 Cu6 S4
  • Reduced Formula: TlCu3S2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m