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-40509
  • 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: 4
  • Number of elements: 3
  • Element list: ['Al', 'Ni', 'Ru']
  • Chemical System: Al-Ni-Ru
  • Density: 6.904542739487609
  • Atomic Density: 0.07781933023878916
  • Unit Cell Volume: 51.401110594578135
  • Molar Volume: 7.73861808052192
  • Full Formula: Al2 Ni1 Ru1
  • Reduced Formula: Al2NiRu
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m