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-48324
  • 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: 27
  • Number of elements: 4
  • Element list: ['Li', 'Mn', 'O', 'F']
  • Chemical System: F-Li-Mn-O
  • Density: 3.497597459501257
  • Atomic Density: 0.08006423230097144
  • Unit Cell Volume: 337.2292373766057
  • Molar Volume: 7.521636799516195
  • Full Formula: Li4 Mn7 O2 F14
  • Reduced Formula: Li4Mn7(OF7)2
  • Formula Anonymous: A2B4C7D14
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m