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-101416
  • 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: 4
  • Number of elements: 2
  • Element list: ['Tl', 'Zn']
  • Chemical System: Tl-Zn
  • Density: 8.34727731584155
  • Atomic Density: 0.05019189868670327
  • Unit Cell Volume: 79.69413599927574
  • Molar Volume: 11.998232618355544
  • Full Formula: Tl1 Zn3
  • Reduced Formula: TlZn3
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m