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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-56187
  • 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: 12
  • Number of elements: 3
  • Element list: ['Nd', 'B', 'Pt']
  • Chemical System: B-Nd-Pt
  • Density: 13.00164730861211
  • Atomic Density: 0.057442945324112836
  • Unit Cell Volume: 208.90293720650772
  • Molar Volume: 10.483690775291922
  • Full Formula: Nd3 B3 Pt6
  • Reduced Formula: NdBPt2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 180
  • Spacegroup Symbol: P6_222
  • Crystal System: hexagonal
  • Pointgroup: 622