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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-75587
  • 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: 3
  • Number of elements: 3
  • Element list: ['Ta', 'Ti', 'As']
  • Chemical System: As-Ta-Ti
  • Density: 8.315813017579337
  • Atomic Density: 0.04946293893608963
  • Unit Cell Volume: 60.6514708694576
  • Molar Volume: 12.175056495897108
  • Full Formula: Ta1 Ti1 As1
  • Reduced Formula: TaTiAs
  • Formula Anonymous: ABC
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m