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-44460
  • 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: 16
  • Number of elements: 3
  • Element list: ['Li', 'Cr', 'O']
  • Chemical System: Cr-Li-O
  • Density: 4.246021926515445
  • Atomic Density: 0.11247545455802992
  • Unit Cell Volume: 142.25325928107324
  • Molar Volume: 5.3541821934962455
  • Full Formula: Li4 Cr4 O8
  • Reduced Formula: LiCrO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m