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-119460
  • 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: 24
  • Number of elements: 3
  • Element list: ['K', 'La', 'F']
  • Chemical System: F-K-La
  • Density: 4.454504715366621
  • Atomic Density: 0.0633683405527403
  • Unit Cell Volume: 378.7380226569961
  • Molar Volume: 9.503390348352085
  • Full Formula: K4 La4 F16
  • Reduced Formula: KLaF4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm