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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10574
  • 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: 16
  • Number of elements: 4
  • Element list: ['Ta', 'Tl', 'Cu', 'S']
  • Chemical System: Cu-S-Ta-Tl
  • Density: 5.694392764438989
  • Atomic Density: 0.04281983464217412
  • Unit Cell Volume: 373.6586125029375
  • Molar Volume: 14.06390475424366
  • Full Formula: Ta2 Tl2 Cu4 S8
  • Reduced Formula: TaTl(CuS2)2
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 40
  • Spacegroup Symbol: Ama2
  • Crystal System: orthorhombic
  • Pointgroup: mm2