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-14974
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 2
  • Element list: ['Ta', 'Sb']
  • Chemical System: Sb-Ta
  • Density: 11.986340778290662
  • Atomic Density: 0.04667771936430834
  • Unit Cell Volume: 192.81147670813073
  • Molar Volume: 12.90153169866472
  • Full Formula: Ta5 Sb4
  • Reduced Formula: Ta5Sb4
  • Formula Anonymous: A4B5
  • Spacegroup Number: 87
  • Spacegroup Symbol: I4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m