1

Regularized   Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear   Scaling Calculations

Liang   Peng, Daoling Peng,

Feng   Long Gu*, Weitao Yang*

Journal   of Chemical Theory and Computation    2022, 18, 5, 2975

2

Automatic Approach to Explore the   Multireaction Mechanism for Medium-Sized Bimolecular Reactions via Collision   Dynamics Simulations and Transition State Searches

Qinghai Cui, Jiawei Peng,

Chao Xu, Zhenggang Lan*

Journal of Chemical Theory and   Computation  2022, 18, 2, 910

3

Agricultural   Plastic Pollution in China: Generation of Plastic Debris and Emission of   Phthalic Acid Esters from Agricultural Films

QianQian   Zhang, ZhaoRong Ma, YaYa Cai, HuiRu Li, Guang Guo Ying*

Environmental Science & Technology

2021, 55, 12459

4

In Situ Insight into the   Availability and Desorption Kinetics of Per- and Polyfluoroalkyl Substances   in Soils

YueRui Huang, SiSi Liu, JinXin   Zi, ShengMing Cheng, Jun Li, GuangGuo Ying, Chang-Er Chen*

Environmental Science &   Technology

2023, 57, 20, 7809

5

Automated   Exploration of Reaction Networks and Mechanisms Based on Metadynamics   Nanoreactor Simulations

Yutai Zhang, Chao Xu,Zhenggang Lan*

Journal   of Chemical Theory and Computation    2023, 19, 23, 8718

6

Influence of Mode-Specific   Excitation on the Nonadiabatic Dynamics of Methyl Nitrate (CH3ONO2)

Juanjuan Zhang, Jiawei Peng,

Yifei Zhu, Deping Hu*,Zhenggang Lan*

The Journal of Physical Chemistry   Letters  2023, 14, 29, 6542

7

Chemical   characteristics and toxicological effects of leachates from plastics under   simulated seawater and fish digest

ShuQing   Qiu, GuoYong Huang*, GuiZhen Fang, XiaoPei Li, DongQiao Lei, WenJun Shi,   Lingtian Xie, GuangGuo Ying

Water   Research

2022,   209, 117892

8

Heterogeneous electro-Fenton   using three-dimension NZVI-BC electrodes for degradation of neonicotinoid   wastewater

Chao Zhang, Feng Li,Rubing Wen,   Huike Zhang, Punniyakotti Elumalai, Qi Zheng, Hongyu Chen, Yujie Yang,   Mingzhi Huang*, Guangguo Ying

Water Research

2020, 182, 115975

9

Strategy   for improving photocatalytic ozonation activity of g-C3N4 by halogen doping   for water purification

Yushan   Tan, Weirui Chen, Gaozu Liao, Xukai Li, Jing Wang, Yiming Tang,

Laisheng   Li

Applied   Catalysis B-Environment and Energy

2022,   306, 121133

10

Fe(II) Oxidation Shaped   Functional Genes and Bacteria Involved in Denitrification and Dissimilatory   Nitrate Reduction to Ammonium from Different Paddy Soils

Dandan Pan，Pengcheng Chen，Guang Yang，Rumiao Niu，Yan Bai，Kuan Cheng，Guoyong Huang，Tongxu Liu，Xiaomin Li*，Fangbai Li

Environmental Science &   Technology

2023, 57, 21156–21167