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-99368
  • 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: 6
  • Number of elements: 3
  • Element list: ['Zr', 'Ge', 'Sb']
  • Chemical System: Ge-Sb-Zr
  • Density: 7.324600240920743
  • Atomic Density: 0.04632990260986263
  • Unit Cell Volume: 129.5059920700703
  • Molar Volume: 12.99838855849012
  • Full Formula: Zr2 Ge2 Sb2
  • Reduced Formula: ZrGeSb
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm