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-63134
  • 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: 21
  • Number of elements: 4
  • Element list: ['Li', 'Cu', 'B', 'O']
  • Chemical System: B-Cu-Li-O
  • Density: 2.605681397393381
  • Atomic Density: 0.10684025006679727
  • Unit Cell Volume: 196.5551371030174
  • Molar Volume: 5.63658429874033
  • Full Formula: Li6 Cu1 B4 O10
  • Reduced Formula: Li6Cu(B2O5)2
  • Formula Anonymous: AB4C6D10
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1