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-15886
  • 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: 6
  • Number of elements: 3
  • Element list: ['U', 'B', 'Ir']
  • Chemical System: B-Ir-U
  • Density: 16.88884182155746
  • Atomic Density: 0.07296909037881419
  • Unit Cell Volume: 82.22659716396899
  • Molar Volume: 8.2530023722873
  • Full Formula: U1 B2 Ir3
  • Reduced Formula: UB2Ir3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm