π§ͺπ Decoding pH Effects in Plasma-Driven Organic Degradation
A key factor influencing plasma-driven degradation is pH, which controls the formation, lifetime, and reactivity of plasma-generated species π¬⚖️. Experimental observations reveal that acidic, neutral, and alkaline conditions lead to distinct degradation pathways and efficiencies. By integrating density functional theory (DFT) calculations, researchers can explain how pH alters molecular orbitals, bond dissociation energies, and reaction sites of contaminants, offering atom-level insight into plasma–pollutant interactions π§ ⚛️.
To further enhance understanding, machine learning (ML) models are applied to correlate experimental parameters, theoretical descriptors, and degradation performance π€π. ML helps predict optimal pH conditions, identify dominant reaction mechanisms, and accelerate process optimization without exhaustive experimentation. Together, non-thermal plasma, DFT analysis, and ML form a smart, data-driven framework for designing next-generation advanced oxidation technologies π♻️.
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