Palladium-doped single-walled carbon nanotubes as a new adsorbent for detecting and trapping volatile organic compounds: a first principle study

HIGHLIGHTS

  • who: Mehdi Yoosefian et al. from the Department of Chemistry, Graduate University of Advanced Technology, Kerman, Iran have published the Article: Palladium-Doped Single-Walled Carbon Nanotubes as a New Adsorbent for Detecting and Trapping Volatile Organic Compounds: A First Principle Study, in the Journal: Nanomaterials 2022, 12, x FOR PEER REVIEW of 10/05/2022
  • what: The authors propose a theoretical computation of Pd-SWCNTs to systematically identify and eliminate the ACN, STY, and PCE as volatile organic compounds using density functional theory (DFT).

SUMMARY

    In the STY-Pd/SWCNT . . .

     

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