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-86694
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Nb', 'Br']
  • Chemical System: Br-Nb
  • Density: 4.398367390821603
  • Atomic Density: 0.03227396657856775
  • Unit Cell Volume: 371.8167077724146
  • Molar Volume: 18.65943792604389
  • Full Formula: Nb2 Br10
  • Reduced Formula: NbBr5
  • Formula Anonymous: AB5
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1