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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-113778
  • 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: 8
  • Number of elements: 3
  • Element list: ['Pr', 'Y', 'Al']
  • Chemical System: Al-Pr-Y
  • Density: 3.890073974668651
  • Atomic Density: 0.04784561589279049
  • Unit Cell Volume: 167.20445229351645
  • Molar Volume: 12.586609342628261
  • Full Formula: Pr1 Y1 Al6
  • Reduced Formula: PrYAl6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2