Quan Zhu

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 12

Top Topics

Molecular Dynamics Simulations

Electron Transfer

Top Venues

The journal of physical chemistry. A

Physical chemistry chemical physics : PCCP

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Yuhong Tang, Yu Yang, Qi Cao, Keli Wang, Dandan Ma, Beibei Liu, Quan Zhu, Jianyi Ma
Theoretical Study of the Temperature- and Pressure-Dependent Rate Constants for Nine Reactions between CO n ( n = 0-4), O m ( m = 1-3), C 2 O, and C 3 O 2 during the Radiolysis of Carbon Dioxide. The journal of physical chemistry. A 128 (19) (2024)
Huajie Xu, Bo Wang, Lingxian Liao, Yang Wang, Quan Zhu, Haisheng Ren
High-Throughput Predictions of Accurate Enthalpies of Formation for Larger Molecules Utilizing the Bond Difference Correction Method. The journal of physical chemistry letters (2024)
Yuhong Tang, Yu Yang, Qi Cao, Keli Wang, Dandan Ma, Beibei Liu, Quan Zhu, Jianyi Ma
Theoretical Study of the Temperature- and Pressure-Dependent Rate Constants for Nine Reactions between CO n ( n = 0-4), O m ( m = 1-3), C 2 O, and C 3 O 2 during the Radiolysis of Carbon Dioxide. The journal of physical chemistry. A (2024)
Huajie Xu, Bo Wang, Lingxian Liao, Yang Wang, Quan Zhu, Haisheng Ren
High-Throughput Predictions of Accurate Enthalpies of Formation for Larger Molecules Utilizing the Bond Difference Correction Method. The journal of physical chemistry letters 15 (4) (2024)
Siyu Chen, Juanqin Li, Quan Zhu, Ze-Rong Li
Theoretical kinetic studies on intramolecular H-migration reactions of peroxy radicals of diethoxymethane. Physical chemistry chemical physics : PCCP (2024)
Tao Li, Siyu Chen, Juanqin Li, Quan Zhu, Ze-Rong Li
Accurate Kinetics of Cyclization Reactions of the Large-Size Hydroperoxy Methyl-Ester Radicals Investigated by the Isodesmic Reaction Correction Method. The journal of physical chemistry. A (2023)
Tao Li, Juanqin Li, Siyu Chen, Quan Zhu, Ze-Rong Li
Investigating the kinetics of the intramolecular H-migration reaction class of methyl-ester peroxy radicals in low-temperature oxidation mechanisms of biodiesel. Physical chemistry chemical physics : PCCP (2023)
Jianxun Zhang, Quan Zhu, Jun Li
Theoretical Investigations for Kinetics of the Chemical Reactions: H + SiCl x ( x = 1, 2, 3). The journal of physical chemistry. A 126 (10) (2022)
Yujie Zhou, Qi Cao, Yu Yang, Dandan Ma, Quan Zhu, Jianyi Ma
Effect of (H 2 O) n ( n = 0-3, 13) on the NH 3 + OH reaction in the gas and liquid phases. RSC advances 12 (43) (2022)
Xiaoxia Yao, Wei-Qiang Pang, Tao Li, Jiangtao Shentu, Ze-Rong Li, Quan Zhu, Xiangyuan Li
High-Pressure-Limit and Pressure-Dependent Rate Rules for Unimolecular Reactions Related to Hydroperoxy Alkyl Radicals in Normal-Alkyl Cyclohexane Combustion. 2. Cyclization Reaction Class. The journal of physical chemistry. A 125 (40) (2021)
Xiaoxia Yao, Wei-Qiang Pang, Tao Li, Jiangtao Shentu, Ze-Rong Li, Quan Zhu, Xiangyuan Li
High-Pressure-Limit and Pressure-Dependent Rate Rules for Unimolecular Reactions Related to Hydroperoxy Alkyl Radicals in Normal Alkyl Cyclohexane Combustion. 1. Concerted HO2 Elimination Reaction Class and β-Scission Reaction Class. The journal of physical chemistry. A 125 (40) (2021)
Huajie Xu, Lijuan Peng, Jingbo Wang, Haisheng Ren, Quan Zhu, Xiangyuan Li
Relationship between Energetic Performance and Clustering Effects on Incremental Nitramine Groups: A Theoretical Perspective. The journal of physical chemistry. A 123 (4) (2019)