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-18019
  • 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: 9
  • Number of elements: 3
  • Element list: ['Yb', 'Li', 'Pb']
  • Chemical System: Li-Pb-Yb
  • Density: 8.669416834133916
  • Atomic Density: 0.04045274574447878
  • Unit Cell Volume: 222.48180770840185
  • Molar Volume: 14.886852917324987
  • Full Formula: Li3 Yb3 Pb3
  • Reduced Formula: LiYbPb
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2