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-106141
  • 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: 8
  • Number of elements: 3
  • Element list: ['Al', 'Ni', 'Ge']
  • Chemical System: Al-Ge-Ni
  • Density: 8.202381065921829
  • Atomic Density: 0.08746855797959562
  • Unit Cell Volume: 91.4614369413317
  • Molar Volume: 6.884920592157043
  • Full Formula: Al1 Ni6 Ge1
  • Reduced Formula: AlNi6Ge
  • Formula Anonymous: ABC6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm