Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-36419
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['Al', 'Ru']
  • Chemical System: Al-Ru
  • Density: 6.08670455781527
  • Atomic Density: 0.07093000852407313
  • Unit Cell Volume: 42.29521555720414
  • Molar Volume: 8.490258052000838
  • Full Formula: Al2 Ru1
  • Reduced Formula: Al2Ru
  • Formula Anonymous: AB2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm