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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-92499
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Al', 'Fe', 'B']
  • Chemical System: Al-B-Fe
  • Density: 5.822394596605418
  • Atomic Density: 0.10937209365823548
  • Unit Cell Volume: 45.71550047879614
  • Molar Volume: 5.506103575943154
  • Full Formula: Al1 Fe2 B2
  • Reduced Formula: Al(FeB)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm