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-37438
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Y', 'Lu', 'Tl']
  • Chemical System: Lu-Tl-Y
  • Density: 10.633201931475293
  • Atomic Density: 0.03807962127881562
  • Unit Cell Volume: 105.0430615029586
  • Molar Volume: 15.814602555803845
  • Full Formula: Y1 Lu1 Tl2
  • Reduced Formula: YLuTl2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m