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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23431
  • 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', 'Ni', 'Sn']
  • Chemical System: Nd-Ni-Sn
  • Density: 8.12599666962395
  • Atomic Density: 0.045642713164880805
  • Unit Cell Volume: 262.91162746287495
  • Molar Volume: 13.194090233517622
  • Full Formula: Nd4 Ni4 Sn4
  • Reduced Formula: NdNiSn
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm