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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119084
  • 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: 16
  • Number of elements: 3
  • Element list: ['Nd', 'Si', 'Pd']
  • Chemical System: Nd-Pd-Si
  • Density: 8.516068162650152
  • Atomic Density: 0.05325990506982731
  • Unit Cell Volume: 300.41360342311776
  • Molar Volume: 11.307081287705206
  • Full Formula: Nd4 Si4 Pd8
  • Reduced Formula: NdSiPd2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm