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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-41421
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 29
  • Number of elements: 3
  • Element list: ['Ti', 'Al', 'Ni']
  • Chemical System: Al-Ni-Ti
  • Density: 4.519796243855671
  • Atomic Density: 0.06986849728486251
  • Unit Cell Volume: 415.06546050022246
  • Molar Volume: 8.619250440505379
  • Full Formula: Ti6 Al16 Ni7
  • Reduced Formula: Ti6Al16Ni7
  • Formula Anonymous: A6B7C16
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m