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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-49923
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Sm', 'Tl', 'O']
  • Chemical System: O-Sm-Tl
  • Density: 9.035138679199804
  • Atomic Density: 0.06755062109450471
  • Unit Cell Volume: 296.0742577336126
  • Molar Volume: 8.91500427742167
  • Full Formula: Sm4 Tl4 O12
  • Reduced Formula: SmTlO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm