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Andreas Heyden

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Sep 2026

Removal of Emerging Contaminants from Wastewater via Adsorption in H-MFI Zeolite: A Hybrid QM/MM Study

Nanoporous adsorbents such as zeolites offer a promising route for the selective removal of contaminants of emerging concern (CECs) from wastewater streams, where conventional technologies such as activated carbon often lack selectivity at sub-ppm concentrations. Here, we employ a first-principles-based hybrid quantu...

M. Zeeshan, S. K. Kundu, Panuwat Watthaisong et al. · 0 citations

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