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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12523
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['K', 'Te', 'Br']
  • Chemical System: Br-K-Te
  • Density: 3.799738807325605
  • Atomic Density: 0.03005500091674321
  • Unit Cell Volume: 598.90199470839
  • Molar Volume: 20.037067297659448
  • Full Formula: K4 Te2 Br12
  • Reduced Formula: K2TeBr6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 128
  • Spacegroup Symbol: P4/mnc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm