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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22777
  • 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: 26
  • Number of elements: 3
  • Element list: ['Y', 'Al', 'Fe']
  • Chemical System: Al-Fe-Y
  • Density: 3.815270266115402
  • Atomic Density: 0.06349534338994521
  • Unit Cell Volume: 409.47884698135556
  • Molar Volume: 9.484381749093169
  • Full Formula: Y2 Al20 Fe4
  • Reduced Formula: Y(Al5Fe)2
  • Formula Anonymous: AB2C10
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm