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-3033
  • 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: 6
  • Number of elements: 3
  • Element list: ['Rb', 'Au', 'Se']
  • Chemical System: Au-Rb-Se
  • Density: 6.166752334072415
  • Atomic Density: 0.030828137170568145
  • Unit Cell Volume: 194.62739402003976
  • Molar Volume: 19.534559375677695
  • Full Formula: Rb2 Au2 Se2
  • Reduced Formula: RbAuSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm