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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116580
  • 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: ['Y', 'Pd', 'S']
  • Chemical System: Pd-S-Y
  • Density: 5.920665434956621
  • Atomic Density: 0.05317429151409766
  • Unit Cell Volume: 300.89728597057194
  • Molar Volume: 11.325286315104734
  • Full Formula: Y2 Pd6 S8
  • Reduced Formula: YPd3S4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 223
  • Spacegroup Symbol: Pm-3n
  • Crystal System: cubic
  • Pointgroup: m-3m