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-70511
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ta', 'Be', 'Sb']
  • Chemical System: Be-Sb-Ta
  • Density: 8.59597240127048
  • Atomic Density: 0.0645599645883004
  • Unit Cell Volume: 61.95790263374591
  • Molar Volume: 9.327980271369816
  • Full Formula: Ta1 Be2 Sb1
  • Reduced Formula: TaBe2Sb
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm