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-21048
  • 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: 17
  • Number of elements: 3
  • Element list: ['Y', 'Ga', 'Pd']
  • Chemical System: Ga-Pd-Y
  • Density: 6.690416600230452
  • Atomic Density: 0.05273970026938723
  • Unit Cell Volume: 322.3378197670125
  • Molar Volume: 11.418610134755646
  • Full Formula: Y4 Ga12 Pd1
  • Reduced Formula: Y4Ga12Pd
  • Formula Anonymous: AB4C12
  • Spacegroup Number: 229
  • Spacegroup Symbol: Im-3m
  • Crystal System: cubic
  • Pointgroup: m-3m