Zhicai Zhai

Nitrogen-sulfur co-doped industrial graphene as an efficient peroxymonosulfate activator: Singlet oxygen-dominated catalytic degradation of organic contaminants

Ping Sun, Hui Liu, Mingbao Feng et al. · Applied Catalysis B: Environmental · 2019 · 386 citations

Materials Science, Graphene Nanomeshes, Chemical Engineering +7

Strategic combination of N-doped graphene and g-C3N4: Efficient catalytic peroxymonosulfate-based oxidation of organic pollutants by non-radical-dominated processes

Ping Sun, Hui Liu, Mingbao Feng et al. · Applied Catalysis B: Environmental · 2020 · 179 citations

Graphene Nanomeshes, Oxygen Reduction Reaction, Chemical Engineering +11

Estimation of n-octanol/water partition coefficients (Kow) of all PCB congeners by density functional theory

Wen Zhou, Zhicai Zhai, Zunyao Wang et al. · Journal of Molecular Structure THEOCHEM · 2005 · 69 citations

Materials Science, Engineering, N-octanol/water Partition Coefficients +6

Prediction of gas phase thermodynamic function of polychlorinated dibenzo-p-dioxins using DFT

Zunyao Wang, Zhicai Zhai, Liansheng Wang et al. · Journal of Molecular Structure THEOCHEM · 2004 · 58 citations

Materials Science, Chemical Engineering, Chemical Thermodynamics +11

Prediction of supercooled liquid vapor pressures and n-octanol/air partition coefficients for polybrominated diphenyl ethers by means of molecular descriptors from DFT method

Zunyao Wang, Xiaolan Zeng, Zhicai Zhai · The Science of The Total Environment · 2007 · 56 citations

Chemical Engineering, Engineering, Polybrominated Diphenyl Ethers +7