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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89016
  • 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: 28
  • Number of elements: 3
  • Element list: ['Ti', 'Sn', 'O']
  • Chemical System: O-Sn-Ti
  • Density: 5.277880377307359
  • Atomic Density: 0.06369847680172422
  • Unit Cell Volume: 439.5709506077559
  • Molar Volume: 9.454136209167547
  • Full Formula: Ti4 Sn8 O16
  • Reduced Formula: Ti(SnO2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 135
  • Spacegroup Symbol: P4_2/mbc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm