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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-41638
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ti', 'Re', 'Pd']
  • Chemical System: Pd-Re-Ti
  • Density: 10.498738957213499
  • Atomic Density: 0.06511970442416667
  • Unit Cell Volume: 61.42534023105231
  • Molar Volume: 9.2478011275572
  • Full Formula: Ti2 Re1 Pd1
  • Reduced Formula: Ti2RePd
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m