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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-37028
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ti', 'In', 'Fe']
  • Chemical System: Fe-In-Ti
  • Density: 8.171005447487445
  • Atomic Density: 0.07173677626970541
  • Unit Cell Volume: 55.759405537842774
  • Molar Volume: 8.394774721070316
  • Full Formula: Ti1 In1 Fe2
  • Reduced Formula: TiInFe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m