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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-18657
  • 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: 2
  • Element list: ['Ti', 'Cd']
  • Chemical System: Cd-Ti
  • Density: 6.3363494911242615
  • Atomic Density: 0.05499779752570286
  • Unit Cell Volume: 54.54763890495742
  • Molar Volume: 10.949785320376861
  • Full Formula: Ti2 Cd1
  • Reduced Formula: Ti2Cd
  • Formula Anonymous: AB2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm