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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105701
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Al', 'Pd', 'O']
  • Chemical System: Al-O-Pd
  • Density: 5.7053709606643395
  • Atomic Density: 0.0947039595816999
  • Unit Cell Volume: 105.5922059032086
  • Molar Volume: 6.358911271080252
  • Full Formula: Al2 Pd2 O6
  • Reduced Formula: AlPdO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm