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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-78833
  • 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: 4
  • Number of elements: 3
  • Element list: ['Tl', 'Cr', 'Se']
  • Chemical System: Cr-Se-Tl
  • Density: 7.707380891325747
  • Atomic Density: 0.044812937343899524
  • Unit Cell Volume: 89.25993780107628
  • Molar Volume: 13.438397741673155
  • Full Formula: Tl1 Cr1 Se2
  • Reduced Formula: TlCrSe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m