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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-39629
  • 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: 4
  • Number of elements: 2
  • Element list: ['Ti', 'Ga']
  • Chemical System: Ga-Ti
  • Density: 5.4773974143134465
  • Atomic Density: 0.0618508151710164
  • Unit Cell Volume: 64.67174262683639
  • Molar Volume: 9.736558432332524
  • Full Formula: Ti3 Ga1
  • Reduced Formula: Ti3Ga
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm