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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-4630
  • 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: 12
  • Number of elements: 3
  • Element list: ['Tl', 'Pt', 'S']
  • Chemical System: Pt-S-Tl
  • Density: 8.628944536746106
  • Atomic Density: 0.04513789096964481
  • Unit Cell Volume: 265.85203123623984
  • Molar Volume: 13.34165294530461
  • Full Formula: Tl2 Pt4 S6
  • Reduced Formula: TlPt2S3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1