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-54871
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Lu', 'Fe', 'Si']
  • Chemical System: Fe-Lu-Si
  • Density: 7.831681621490327
  • Atomic Density: 0.06878593511676188
  • Unit Cell Volume: 72.68927857871908
  • Molar Volume: 8.754901346877983
  • Full Formula: Lu1 Fe2 Si2
  • Reduced Formula: Lu(FeSi)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm