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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119130
  • 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: 18
  • Number of elements: 4
  • Element list: ['Ti', 'Nb', 'Ga', 'O']
  • Chemical System: Ga-Nb-O-Ti
  • Density: 5.131635764695828
  • Atomic Density: 0.0907463125991264
  • Unit Cell Volume: 198.35516710761956
  • Molar Volume: 6.636237426641151
  • Full Formula: Ti2 Nb2 Ga2 O12
  • Reduced Formula: TiNbGaO6
  • Formula Anonymous: ABCD6
  • Spacegroup Number: 102
  • Spacegroup Symbol: P4_2nm
  • Crystal System: tetragonal
  • Pointgroup: 4mm