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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-50952
  • 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: 16
  • Number of elements: 3
  • Element list: ['Tm', 'Ti', 'O']
  • Chemical System: O-Ti-Tm
  • Density: 6.8084541569973105
  • Atomic Density: 0.07042922939419019
  • Unit Cell Volume: 227.17840501205117
  • Molar Volume: 8.550627078842885
  • Full Formula: Tm4 Ti2 O10
  • Reduced Formula: Tm2TiO5
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm