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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-15770
  • 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: 6
  • Number of elements: 3
  • Element list: ['Nd', 'Al', 'Ni']
  • Chemical System: Al-Nd-Ni
  • Density: 5.68260164872861
  • Atomic Density: 0.05993709747190131
  • Unit Cell Volume: 100.10494757129035
  • Molar Volume: 10.047434750778843
  • Full Formula: Nd1 Al3 Ni2
  • Reduced Formula: NdAl3Ni2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm