Dong-Qi Wang (Dongqi Wang)

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 22

Top Topics

Crystal Structure

Hydrogen Peroxide

Molecular Dynamics

Top Venues

Inorganic chemistry

The journal of physical chemistry letters

The journal of physical chemistry. A

Environmental science & technology

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

Publications

Xin Yan, Hui Jiang, Ziyi Liu, Dong-Qi Wang
Computational Comparative Study of the Binding of Americium with N-Donor Ligands. Inorganic chemistry (2024)
Ziyi Liu, An-Hui Lu, Dong-Qi Wang
Deep Potential Molecular Dynamics Study of Propane Oxidative Dehydrogenation. The journal of physical chemistry. A (2024)
Weixi Chen, Yuchen Liu, Ziyi Liu, Lihan Zhu, Dong-Qi Wang
In Situ Formation of B═O Bond in Oxidative Dehydrogenation of Propane and as a Hunter for Alkoxyl Radicals: A Computational Study. The journal of physical chemistry letters (2024)
Xin Yan, Hui Jiang, Ziyi Liu, Dong-Qi Wang
Computational Comparative Study of the Binding of Americium with N-Donor Ligands. Inorganic chemistry 63 (18) (2024)
Ziyi Liu, An-Hui Lu, Dong-Qi Wang
Deep Potential Molecular Dynamics Study of Propane Oxidative Dehydrogenation. The journal of physical chemistry. A 128 (9) (2024)
Junqing Li, Ziyi Liu, Zhehuan Zhao, Dong-Qi Wang
A Connected Convolutional Neutral Network Protocol for Design of Two-Dimensional Materials Based on Modified Graphdiyne. The journal of physical chemistry letters (2024)
Junqing Li, Ziyi Liu, Zhehuan Zhao, Dong-Qi Wang
A Connected Convolutional Neutral Network Protocol for Design of Two-Dimensional Materials Based on Modified Graphdiyne. The journal of physical chemistry letters 15 (31) (2024)
Ziyi Liu, Qin Wang, Zhifang Chai, Dong-Qi Wang
Recognition of Actinides by Siderocalin. Inorganic chemistry (2023)
Qin Wang, Ziyi Liu, Yu-Fei Song, Zhifang Chai, Dong-Qi Wang
Chelation Behaviors of 3,4,3-LI(1,2-HOPO) with Lanthanides and Actinides Implicated by Molecular Dynamics Simulations. Inorganic chemistry (2023)
Tu Lan, Peng Wu, Xiaoyu Yin, Yufan Zhao, Jiali Liao, Dong-Qi Wang, Ning Liu
Rigidity and Flexibility: Unraveling the Role of Fulvic Acid in Uranyl Sorption on Graphene Oxide Using Molecular Dynamics Simulations. Environmental science & technology (2023)
Qin Wang, Ziyi Liu, Yu-Fei Song, Zhifang Chai, Dong-Qi Wang
Chelation Behaviors of 3,4,3-LI(1,2-HOPO) with Lanthanides and Actinides Implicated by Molecular Dynamics Simulations. Inorganic chemistry 62 (10) (2023)
Ziyi Liu, Qin Wang, Zhifang Chai, Dong-Qi Wang
Recognition of Actinides by Siderocalin. Inorganic chemistry 63 (2) (2023)
Yuchen Liu, Ziyi Liu, Wen-Duo Lu, Dong-Qi Wang, An-Hui Lu
In Situ Generated Boron Peroxo as Mild Oxidant in Propane Oxidative Dehydrogenation Revealed by Density Functional Theory Study. The journal of physical chemistry letters 13 (50) (2022)
Hui Jiang, Ziyi Liu, Lei He, Zhifang Chai, Dong-Qi Wang
The Speciation of Americium Cations in Neat Water Implicated from DFT Studies. Inorganic chemistry 61 (35) (2022)
Qin Wang, Ziyi Liu, Miaoren Xia, Yu-Fei Song, Zhifang Chai, Dong-Qi Wang
Biphasic Behaviors of Nd 3+ Bound with Cyanex272, Cyanex301, and Cyanex302: A Molecular Dynamics Simulation Study. Inorganic chemistry 61 (23) (2022)
Tu Lan, Peng Wu, Ziyi Liu, Martin Stroet, Jiali Liao, Zhifang Chai, Alan E Mark, Ning Liu, Dong-Qi Wang
Understanding the Effect of pH on the Solubility and Aggregation Extent of Humic Acid in Solution by Combining Simulation and the Experiment. Environmental science & technology 56 (2) (2022)
Yuchen Liu, Ziyi Liu, Wen-Duo Lu, Dong-Qi Wang, An-Hui Lu
In Situ Generated Boron Peroxo as Mild Oxidant in Propane Oxidative Dehydrogenation Revealed by Density Functional Theory Study. The journal of physical chemistry letters (2022)
Lu Hou, Wen-Cui Li, Chen-Yu Liu, Yu Zhang, Wei-Hong Qiao, Jia Wang, Dong-Qi Wang, Chuan-Hong Jin, An-Hui Lu
Selective Synthesis of Carbon Nanorings via Asymmetric Intramicellar Phase-Transition-Induced Tip-to-Tip Assembly. ACS central science 7 (9) (2021)
Ziyi Liu, Deting Xu, Miaoren Xia, Wen-Duo Lu, An-Hui Lu, Dong-Qi Wang
Understanding the Unique Antioxidation Property of Boron-Based Catalysts during Oxidative Dehydrogenation of Alkanes. The journal of physical chemistry letters 12 (36) (2021)
Miaoren Xia, Xia Yang, Zhifang Chai, Dong-Qi Wang
Stronger Hydration of Eu(III) Impedes Its Competition against Am(III) in Binding with N-donor Extractants. Inorganic chemistry 59 (9) (2020)
Yanxiao Liu, Ruozhuang Liu, Wanjian Ding, Dong-Qi Wang
Evaluation of Influencing Factors in Tetravalent Uranium Complex-Mediated CO2 Functionalization by Density Functional Theory. The journal of physical chemistry. A 124 (13) (2020)
Wanjian Ding, Yanxiao Liu, Dong-Qi Wang
Computational Comparative Mechanistic Study of C-E (E=C,N,O,S) Coupling Reactions through CO2 Activation Mediated by Uranium(III) Complexes. Chemistry (Weinheim an der Bergstrasse, Germany) 24 (72) (2018)