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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111320
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Nd', 'Ni', 'As']
  • Chemical System: As-Nd-Ni
  • Density: 7.752473581364193
  • Atomic Density: 0.050407030049223533
  • Unit Cell Volume: 59.515507997008285
  • Molar Volume: 11.94702555202965
  • Full Formula: Nd1 Ni1 As1
  • Reduced Formula: NdNiAs
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2