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-117319
  • 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: 28
  • Number of elements: 5
  • Element list: ['Li', 'V', 'Cr', 'Fe', 'O']
  • Chemical System: Cr-Fe-Li-O-V
  • Density: 4.4229031596329245
  • Atomic Density: 0.10589734422625131
  • Unit Cell Volume: 264.4070085476135
  • Molar Volume: 5.686772226443757
  • Full Formula: Li4 V3 Cr3 Fe2 O16
  • Reduced Formula: Li4V3Cr3(FeO8)2
  • Formula Anonymous: A2B3C3D4E16
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m