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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101587
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['Mg', 'Tl']
  • Chemical System: Mg-Tl
  • Density: 4.981386458422983
  • Atomic Density: 0.04327269289851106
  • Unit Cell Volume: 92.43704821840736
  • Molar Volume: 13.916722895253908
  • Full Formula: Mg3 Tl1
  • Reduced Formula: Mg3Tl
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm