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-61494
  • 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: 6
  • Number of elements: 3
  • Element list: ['Tb', 'B', 'Ir']
  • Chemical System: B-Ir-Tb
  • Density: 15.310223500450421
  • Atomic Density: 0.07305905065849772
  • Unit Cell Volume: 82.12534854916188
  • Molar Volume: 8.242840148785245
  • Full Formula: Tb1 B2 Ir3
  • Reduced Formula: TbB2Ir3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm