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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3843
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['K', 'Tl', 'O']
  • Chemical System: K-O-Tl
  • Density: 6.119432240730602
  • Atomic Density: 0.04260668296063741
  • Unit Cell Volume: 140.8229785346857
  • Molar Volume: 14.134263316305596
  • Full Formula: K2 Tl2 O2
  • Reduced Formula: KTlO
  • Formula Anonymous: ABC
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m