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Author:

Ma, L. (Ma, L..) | Liu, T. (Liu, T..) | Li, J. (Li, J..) | Yang, Q. (Yang, Q..)

Indexed by:

EI Scopus SCIE

Abstract:

The coexistence of highly toxic heavy metal chromium and new pollutants microplastics has been widely present, and the interaction behavior and mechanism of the two are crucial for their environmental effects in coexisting environments, which urgently need to be further explored. Firstly, the interaction characteristics of polyamide (PA) and polyethylene (PE) with Cr(VI)/Cr(III) were investigated, where PA exhibited higher adsorption capacity of both Cr(VI) and Cr(III) than PE among various environmental conditions. The higher adsorption energy of PA on Cr(VI)/Cr(III) was also achieved by DFT calculation, and the bending configuration of PA during the adsorption process may be beneficial for its interaction with Cr. Then, the combination of characterization analysis and DFT calculation showed that significant chemical bonding occurred in the interaction between C[dbnd]O bond of PA and Cr(III), weak chemical interactions occurred in the adsorption of PE with Cr(III) and PA with Cr(VI), while the adsorption of PE with Cr(VI) was mainly physical effects. This study provides theoretical support for pollution control of microplastics and chromium in co-existing environment. © 2024

Keyword:

Cr(III) Cr(VI) DFT calculation Microplastics Interaction mechanism

Author Community:

  • [ 1 ] [Ma L.]National Engineering Laboratory for Advanced Municipal Wastewater Treatment and Reuse Technology, Beijing University of Technology, Beijing, 100124, China
  • [ 2 ] [Liu T.]The Key Laboratory of Orogenic Belts and Crustal Evolution, Beijing Key Laboratory of Mineral Environmental Function, School of Earth and Space Sciences, Peking University, Beijing, 100871, China
  • [ 3 ] [Li J.]National Engineering Laboratory for Advanced Municipal Wastewater Treatment and Reuse Technology, Beijing University of Technology, Beijing, 100124, China
  • [ 4 ] [Yang Q.]National Engineering Laboratory for Advanced Municipal Wastewater Treatment and Reuse Technology, Beijing University of Technology, Beijing, 100124, China

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Source :

Journal of Hazardous Materials

ISSN: 0304-3894

Year: 2024

Volume: 476

1 3 . 6 0 0

JCR@2022

Cited Count:

WoS CC Cited Count:

SCOPUS Cited Count: 6

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 3

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