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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10185
  • 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: 4
  • Element list: ['Na', 'Tl', 'S', 'O']
  • Chemical System: Na-O-S-Tl
  • Density: 6.1917511100403635
  • Atomic Density: 0.05619367423075251
  • Unit Cell Volume: 213.5471681514089
  • Molar Volume: 10.71675921255978
  • Full Formula: Na1 Tl3 S2 O6
  • Reduced Formula: NaTl3(SO3)2
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1