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-16718
  • 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: ['Tm', 'Fe', 'B']
  • Chemical System: B-Fe-Tm
  • Density: 8.529378992578101
  • Atomic Density: 0.08497231595797844
  • Unit Cell Volume: 58.84269416020933
  • Molar Volume: 7.087179738608211
  • Full Formula: Tm1 Fe2 B2
  • Reduced Formula: Tm(FeB)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm