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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102099
  • 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: 7
  • Number of elements: 4
  • Element list: ['Li', 'Ti', 'Sb', 'O']
  • Chemical System: Li-O-Sb-Ti
  • Density: 4.960054114508771
  • Atomic Density: 0.056643445320004586
  • Unit Cell Volume: 123.58005344579264
  • Molar Volume: 10.631663956841232
  • Full Formula: Li2 Ti2 Sb2 O1
  • Reduced Formula: Li2Ti2Sb2O
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm