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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-43094
  • 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: 12
  • Number of elements: 3
  • Element list: ['Ti', 'Te', 'O']
  • Chemical System: O-Te-Ti
  • Density: 3.266881338583079
  • Atomic Density: 0.059139699047125106
  • Unit Cell Volume: 202.9093856300803
  • Molar Volume: 10.182907348245541
  • Full Formula: Ti3 Te1 O8
  • Reduced Formula: Ti3TeO8
  • Formula Anonymous: AB3C8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1