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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22137
  • 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', 'Pd', 'S']
  • Chemical System: Nd-Pd-S
  • Density: 6.364721507710042
  • Atomic Density: 0.05181711408420962
  • Unit Cell Volume: 308.77829232245347
  • Molar Volume: 11.621914624989012
  • Full Formula: Nd2 Pd6 S8
  • Reduced Formula: NdPd3S4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 223
  • Spacegroup Symbol: Pm-3n
  • Crystal System: cubic
  • Pointgroup: m-3m