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-121280
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['As', 'Br']
  • Chemical System: As-Br
  • Density: 3.6534464891443235
  • Atomic Density: 0.028119464725826902
  • Unit Cell Volume: 106.68766383894172
  • Molar Volume: 21.41627096645563
  • Full Formula: As1 Br2
  • Reduced Formula: AsBr2
  • Formula Anonymous: AB2
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2