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-5176
  • 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: 4
  • Number of elements: 2
  • Element list: ['Cu', 'Br']
  • Chemical System: Br-Cu
  • Density: 5.395589518988105
  • Atomic Density: 0.045302195298370096
  • Unit Cell Volume: 88.29594181154205
  • Molar Volume: 13.293264753146891
  • Full Formula: Cu2 Br2
  • Reduced Formula: CuBr
  • Formula Anonymous: AB
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm