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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-105604
  • 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: 10
  • Number of elements: 4
  • Element list: ['K', 'Tl', 'Cu', 'F']
  • Chemical System: Cu-F-K-Tl
  • Density: 4.676840503207
  • Atomic Density: 0.06121189502924909
  • Unit Cell Volume: 163.36694028540802
  • Molar Volume: 9.838187099292417
  • Full Formula: K2 Tl1 Cu1 F6
  • Reduced Formula: K2TlCuF6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m