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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-92597
  • 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: ['Nd', 'Al', 'Cu']
  • Chemical System: Al-Cu-Nd
  • Density: 4.981652735673409
  • Atomic Density: 0.05195155025854854
  • Unit Cell Volume: 96.24351872304827
  • Molar Volume: 11.591840339757843
  • Full Formula: Nd1 Al3 Cu1
  • Reduced Formula: NdAl3Cu
  • Formula Anonymous: ABC3
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm