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-86872
  • 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: 16
  • Number of elements: 3
  • Element list: ['Ce', 'Sb', 'Au']
  • Chemical System: Au-Ce-Sb
  • Density: 8.87926286461818
  • Atomic Density: 0.03626580707798826
  • Unit Cell Volume: 441.18692755389674
  • Molar Volume: 16.605561120009305
  • Full Formula: Ce6 Sb6 Au4
  • Reduced Formula: Ce3Sb3Au2
  • Formula Anonymous: A2B3C3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm