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-118228
  • 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: 3
  • Element list: ['Rb', 'Cu', 'Se']
  • Chemical System: Cu-Rb-Se
  • Density: 4.679521837890292
  • Atomic Density: 0.03708418143708782
  • Unit Cell Volume: 80.8970262722236
  • Molar Volume: 16.239109309224954
  • Full Formula: Rb1 Cu1 Se1
  • Reduced Formula: RbCuSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2