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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-67643
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ti', 'Be', 'Ir']
  • Chemical System: Be-Ir-Ti
  • Density: 14.440817578767218
  • Atomic Density: 0.06318977871767416
  • Unit Cell Volume: 94.95206537765263
  • Molar Volume: 9.530245052615777
  • Full Formula: Ti1 Be1 Ir4
  • Reduced Formula: TiBeIr4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m