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-85340
  • 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: 12
  • Number of elements: 4
  • Element list: ['K', 'U', 'Cu', 'Se']
  • Chemical System: Cu-K-Se-U
  • Density: 6.112762884619655
  • Atomic Density: 0.03824262550950546
  • Unit Cell Volume: 313.78598723608343
  • Molar Volume: 15.747194863760482
  • Full Formula: K2 U2 Cu2 Se6
  • Reduced Formula: KUCuSe3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm