Full insights into the roles of pH on hydroxylation of aromatic acids/bases and toxicity evaluation

An experimental and theoretical study on the degradation of clonidine by hydroxyl and sulfate radicals

(2020) Ruiyang Xiao et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Formation of Low-Volatile Products and Unexpected High Formaldehyde Yield from the Atmospheric Oxidation of Methylsiloxanes

(2020) Zihao Fu et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Effect of low-level H2O2 and Fe(II) on the UV treatment of tetracycline antibiotics and the toxicity of reaction solutions to zebrafish embryos

(2020) Ting Zhao et al.   CHEMICAL ENGINEERING JOURNAL

Simultaneous disinfection of E. faecalis and degradation of carbamazepine by sulfate radicals: An experimental and modelling study

(2020) Kai Liu et al.   ENVIRONMENTAL POLLUTION

Potential Difference Driving Electron Transfer via Defective Carbon Nanotubes toward Selective Oxidation of Organic Micropollutants

(2020) Penghui Shao et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Effect of pH on ·OH-induced degradation progress of syringol/syringaldehyde and health effect

(2020) Zexiu An et al.   CHEMOSPHERE

N-Nitrosodimethylamine (NDMA) Degradation by the Ultraviolet/Peroxodisulfate Process

(2019) Inmaculada Velo-Gala et al.   Environmental Science & Technology Letters

Predicting the Contribution of Chloramines to Contaminant Decay during UV/Hydrogen Peroxide Advanced Oxidation Process (AOP) Treatment for Potable Reuse

(2019) Zhong Zhang et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Overlooked Role of Peroxides as Free Radical Precursors in Advanced Oxidation Processes

(2019) Zhihao Chen et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Membrane technology coupled with electrochemical advanced oxidation processes for organic wastewater treatment: Recent advances and future prospects

(2019) Zonglin Pan et al.   CHEMICAL ENGINEERING JOURNAL

Oxidative degradation of iodinated X-ray contrast media (iomeprol and iohexol) with sulfate radical: An experimental and theoretical study

(2019) Xiaoxiao Wang et al.   CHEMICAL ENGINEERING JOURNAL

Electrophilicity index as a critical indicator for the biodegradation of the pharmaceuticals in aerobic activated sludge processes

(2019) Zongsu Wei et al.   WATER RESEARCH

The individual and Co-exposure degradation of benzophenone derivatives by UV/H2O2 and UV/PDS in different water matrices

(2019) Jinming Luo et al.   WATER RESEARCH

Sulfate and hydroxyl radicals-initiated degradation reaction on phenolic contaminants in the aqueous phase: Mechanisms, kinetics and toxicity assessment

(2019) Qiong Mei et al.   CHEMICAL ENGINEERING JOURNAL

Mechanistic insights into the reactive radicals-assisted degradation of sulfamethoxazole via calcium peroxide activation by manganese-incorporated iron oxide–graphene nanocomposite: Formation of radicals and degradation pathway

(2019) Amina et al.   CHEMICAL ENGINEERING JOURNAL

Experimental and theoretical insight into hydroxyl and sulfate radicals-mediated degradation of carbamazepine

(2019) Ruiyang Xiao et al.   ENVIRONMENTAL POLLUTION

Feasibility of carbon-doped BN nanosheets as photocatalyst for degradation of 4-chloroguaiacol and ecotoxicity fate during indirect photochemical transformation

(2019) Bo Wei et al.   JOURNAL OF CATALYSIS

Theoretical study on the mechanisms, kinetics and ecotoxicity assessment of OH-initiated reactions of guaiacol in atmosphere and wastewater

(2019) Zexiu An et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Efficient removal of parabens from real water matrices by a metal-free carbon nitride photocatalyst

(2019) Raquel A. Fernandes et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Treatment of organosilicon wastewater by UV-based advanced oxidation processes: Performance comparison and fluorescence parallel factor analysis

(2019) Heng Lin et al.   CHEMICAL ENGINEERING JOURNAL

Theoretical investigation on the degradation of dibutyl phthalate initiated by OH and SO4·- in aqueous solution: Mechanism, kinetics and ecotoxicity assessment

(2019) Jianfei Sun et al.   CHEMICAL ENGINEERING JOURNAL

Radical chemistry of diethyl phthalate oxidation via UV/peroxymonosulfate process: Roles of primary and secondary radicals

(2019) Yu Lei et al.   CHEMICAL ENGINEERING JOURNAL

Removal of parabens from water by UV-driven advanced oxidation processes

(2019) Miguel A. Álvarez et al.   CHEMICAL ENGINEERING JOURNAL

Theoretical insight into the degradation of p-nitrophenol by OH radicals synergized with other active oxidants in aqueous solution

(2019) Qiong Mei et al.   JOURNAL OF HAZARDOUS MATERIALS

Addition and Correction to Environmental Implications of Hydroxyl Radicals (•OH)

(2018) Sasho Gligorovski et al.   CHEMICAL REVIEWS

Degradation and mineralization of aniline by O 3 /Fenton process enhanced using high-gravity technology

(2018) Yuejiao Qin et al.   CHINESE JOURNAL OF CHEMICAL ENGINEERING

Quantitative structure–activity relationships for reactivities of sulfate and hydroxyl radicals with aromatic contaminants through single–electron transfer pathway

(2018) Shuang Luo et al.   JOURNAL OF HAZARDOUS MATERIALS

Comparative study on degradation of propranolol and formation of oxidation products by UV/H2O2 and UV/persulfate (PDS)

(2018) Yi Yang et al.   WATER RESEARCH

Hydroxyl radical-mediated degradation of diclofenac revisited: a computational approach to assessment of reaction mechanisms and by-products

(2017) Sesil Agopcan Cinar et al.   ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH

A DFT study of proton transfers for the reaction of phenol and hydroxyl radical leading to dihydroxybenzene and H2 O in the water cluster

(2017) Shinichi Yamabe et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Development of Prediction Models for the Reactivity of Organic Compounds with Ozone in Aqueous Solution by Quantum Chemical Calculations: The Role of Delocalized and Localized Molecular Orbitals

(2015) Minju Lee et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Reaction pathway of the degradation of the p-hydroxybenzoic acid by sulfate radical generated by ionizing radiations

(2015) Justine Criquet et al.   RADIATION PHYSICS AND CHEMISTRY

Comparison of Halide Impacts on the Efficiency of Contaminant Degradation by Sulfate and Hydroxyl Radical-Based Advanced Oxidation Processes (AOPs)

(2014) Yi Yang et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

The Role of pH in the Mechanism of.OH Radical Induced Oxidation of Nicotine

(2014) Katarzyna Kosno et al.   ISRAEL JOURNAL OF CHEMISTRY

Oxidation of the Antiviral Drug Acyclovir and Its Biodegradation Product Carboxy-acyclovir with Ozone: Kinetics and Identification of Oxidation Products

(2012) Carsten Prasse et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

CuO supported Clinoptilolite towards solar photocatalytic degradation of p-aminophenol

(2012) Alireza Nezamzadeh-Ejhieh et al.   POWDER TECHNOLOGY

Advanced Oxidation Processes for Wastewater Treatment: Formation of Hydroxyl Radical and Application

(2011) JIAN LONG WANG et al.   CRITICAL REVIEWS IN ENVIRONMENTAL SCIENCE AND TECHNOLOGY

Multiwfn: A multifunctional wavefunction analyzer

(2011) Tian Lu et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Average local ionization energy: A review

(2010) Peter Politzer et al.   JOURNAL OF MOLECULAR MODELING

Photochemical removal of aniline in aqueous solutions: Switching from photocatalytic degradation to photo-enhanced polymerization recovery

(2009) Heqing Tang et al.   JOURNAL OF HAZARDOUS MATERIALS

Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions

(2009) Aleksandr V. Marenich et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Toxicity and quantitative structure–activity relationships of benzoic acids to Pseudokirchneriella subcapitata

(2008) Po Yi Lee et al.   JOURNAL OF HAZARDOUS MATERIALS

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06 functionals and 12 other functionals

(2008) Yan Zhao et al.   THEORETICAL CHEMISTRY ACCOUNTS