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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-26046
  • 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: 18
  • Number of elements: 3
  • Element list: ['Al', 'B', 'Ru']
  • Chemical System: Al-B-Ru
  • Density: 7.809164762721847
  • Atomic Density: 0.08350672407085118
  • Unit Cell Volume: 215.55150438817265
  • Molar Volume: 7.2115638914185185
  • Full Formula: Al6 B4 Ru8
  • Reduced Formula: Al3(BRu2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm