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-90869
  • 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: 8
  • Number of elements: 2
  • Element list: ['Fe', 'B']
  • Chemical System: B-Fe
  • Density: 6.887875225721495
  • Atomic Density: 0.12445917595099054
  • Unit Cell Volume: 64.2781051607656
  • Molar Volume: 4.838647463302662
  • Full Formula: Fe4 B4
  • Reduced Formula: FeB
  • Formula Anonymous: AB
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm