孟庆喜｜山东农业大学｜学者主页

2026

Theoretical Investigations of Ni/( R , R )‐Me‐DuPhos‐Catalyzed Enantioselective Hydroalkoxylation of 1,3‐Dienes With Methanol

Chengkun Li, Fen Wang, Qingxi Meng

Applied Organometallic Chemistry

DOI

2025

MestReNova和DeepSeek软件在波谱分析教学中的应用

李成坤，刘腾，黄丹丹，井广琴，孟庆喜，朱树华，尚鹏鹏，张丽丽

《广东化工》

2024

《化学软件及应用》课程教学改革探索与实践

孟庆喜，陈长宝，朱树华

《广东化工》

2024

Theoretical study of Ni(0)-catalyzed intermolecular hydroamination of branched 1,3-dienes: reaction mechanism, regioselectivity, enantioselectivity, and prediction of the ligand

Fen Wang, Changbao Chen, Feng Zhang, Qingxi Meng

Journal of Molecular Modeling

DOI

2024

Theoretical investigations of Co-catalyzed allylic aminations

Qingxi Meng, Fen Wang

Molecular Catalysis

DOI

2023

Comprehensive Theoretical Study of Cp*IrIII-Catalyzed Intermolecular Enantioselective Allylic C–H Amidation: Reaction Mechanism, Electronic Processes, and Regioselectivity

Fen Wang, Changbao Chen, Qingxi Meng

The Journal of Organic Chemistry

DOI

2022

基础化学实验“小班化”教学的思考与尝试

孟庆喜，陈长宝，朱树华，张丽丽

《科技视界》

2022

Comprehensive theoretical study of nickel‐NHC‐catalyzed enantioselective intramolecular indole C—H cyclization: Reaction mechanism, reactivity, regioselectivity, and electronic processes

Fen Wang, Changbao Chen, Feng Zhang, Qingxi Meng

Applied Organometallic Chemistry

DOI

2022

Theoretical Study of N–H σ-Bond Activation by Nickel(0) Complex: Reaction Mechanism, Electronic Processes, and Prediction of Better Ligand

Qingxi Meng, Bo Zhu, Shigeyoshi Sakaki

Inorganic Chemistry

DOI

2020

Strategy Used to Control the Mechanism of Homogeneous Alkyne/Olefin Hydrogenation: AIMD Simulations and DFT Calculations

Yafei Luo, Zheng Huang, Zhong‐Zhu Chen, Zhigang Xu, Jiang Ping Meng, Hongyu Li, Qingxi Meng, Dianyong Tang

The Journal of Organic Chemistry

DOI

2020

Theoretical Insight into Ni(0)-Catalyzed Hydroarylation of Alkenes and Arylboronic Acids

Fen Wang, Qingxi Meng

The Journal of Organic Chemistry

DOI

2020

Phosphine ligand-coated Cu nanoparticle-catalyzed selective semihydrogenation of alkynes: electronic or hindrance effects of the ligand?

Yafei Luo, Zheng Huang, Zhong‐Zhu Chen, Zhigang Xu, Jianping Hu, Qingxi Meng, Dianyong Tang

Physical Chemistry Chemical Physics

DOI

2019

大数据背景下农林院校研究生化学信息基础课程教学改革探索与实践

朱树华，尹洪宗，黄丹丹，孟庆喜，张丽丽，张瑞霞

《山东化工》

DOI

2019

Highly efficient blue-emitting of bis-cyclometalated tetravalent platinum (IV) complexes: A theoretical study

Huize Zhang, Yafei Luo, Xi Yan, Wanlin Cai, Ancong Zhao, Qingxi Meng, Wei Shen

Inorganica Chimica Acta

DOI

2019

Density Functional Computations for Co(I)‐Catalyzed Intermolecular Hydroacylation of Benzaldehydes

Fen Wang, Qingxi Meng

ChemistrySelect

DOI

2019

Density functional calculations for Rh(I)‐catalyzed C–C bond activation of siloxyvinylcyclopropanes and diazoesters

Qingxi Meng, Fen Wang, Ping Qian

Applied Organometallic Chemistry

DOI

2019

What accounts for the color purity of tetradentate Pt complexes? A computational analysis

Wanlin Cai, Huize Zhang, Xi Yan, Anchong Zhao, Rongxing He, Ming Li, Qingxi Meng, Wei Shen

Physical Chemistry Chemical Physics

DOI

2019

Small substituent groups as geometric controllers for tridentate platinum( ii ) complexes to effectively suppress non-radiative decay processes

Yafei Luo, Zhong‐Zhu Chen, Jianping Hu, Zhigang Xu, Qingxi Meng, Dianyong Tang

Physical Chemistry Chemical Physics

DOI

2018

提高《高等无机化学》“群论”教学质量的思考与尝试——量子化学计算方法及其相关软件的应用

孟庆喜，朱树华

《山东化工》

2018

Mechanism for Co(dppp)-catalyzed regioselective intermolecular hydroacylation of 1,3-dienes and benzaldehydes: Insights from density functional calculations

Qingxi Meng, Fen Wang

Journal of Organometallic Chemistry

DOI

2017

铜络合物手性催化羰基ene反应的密度泛函研究

孟庆喜

《山东化工》

DOI

2017

提升《结构化学》教学质量的思考与尝试——多种教学方法的应用

孟庆喜，尹洪宗

《山东化工》

2017

Mechanism for ruthenium hydride-catalyzed regioselective hydroacylation of enones and aldehydes to give 1,3-diketones: Insights from density functional calculations

Fen Wang, Qingxi Meng

Molecular Catalysis

DOI

2017

Theoretical Studies for Switching Regioselectivity in Ruthenium Hydride‐Catalyzed Alkyne Hydroacylation

Fen Wang, Qingxi Meng

ChemistrySelect

DOI

2016

《结构化学》教学中设置课程论文的思考与尝试

孟庆喜，尹洪宗

《广州化工》

2016

Mechanisms for nickel(0)/N-heterocyclic carbene-catalyzed intramolecular alkene hydroacylation: insights from a DFT study

Qingxi Meng, Fen Wang

Journal of Molecular Modeling

DOI

2016

Substituent effect and ligand exchange control the reactivity in ruthenium(II)-catalyzed hydroacylation of isoprenes and aldehydes ‖ A DFT study

Qingxi Meng, Peiying Su, Fen Wang, Shuhua Zhu

Journal of Theoretical and Computational Chemistry

DOI

2016

Mechanisms and reactivity differences for the cobalt-catalyzed enantioselective intramolecular hydroacylation of ketones and alkenes: insights from density functional calculations

Qingxi Meng, Fen Wang

Journal of Molecular Modeling

DOI

2015

Theoretical studies of nickel-catalyzed ring-opening hydroacylation of methylenecyclopropanes and benzaldehydes

Fen Wang, Shuhua Zhu, Qingxi Meng, Hongzong Yin

Journal of Molecular Modeling

DOI

2015

Theoretical studies of cobalt(I)-catalyzed hydroacylation of vinylsilanes and alkyl aldehydes

Qingxi Meng, Fen Wang, Hongzong Yin

Journal of Physical Organic Chemistry

DOI

2014

Theoretical studies of palladium-catalyzed cycloaddition of alkynyl aryl ethers and alkynes

Qingxi Meng, Fen Wang

Journal of Molecular Modeling

DOI

2013

Nickel/zinc-catalyzed decarbonylative addition of anhydrides to alkynes: A DFT study

Qingxi Meng, Ming Li

Journal of Molecular Modeling

DOI

2013

Theoretical studies of ruthenium hydride-catalyzed addition reactions of benzaldehydes to isoprenes leading to β,γ-unsaturated ketones: The role of the ligands hydride, carbonyl, chloride, and triphenylphosphine of the catalyst

Fen Wang, Qingxi Meng, Ming Li

Journal of Organometallic Chemistry

DOI

2013

Theoretical investigation of Co(0)-catalyzed intramolecular hydroacylation of 4-pentenal

Qingxi Meng, Fen Wang, Ming Li

Journal of Molecular Modeling

DOI

2012

几种过渡金属催化酰化、环化反应的理论研究

孟庆喜

《西南大学》

2012

Theoretical studies on the Mo-catalyzed asymmetric intramolecular Pauson-Khand-type [2 + 2 + 1] cycloadditions of 3-allyloxy-1-propynylphosphonates

Qingxi Meng, Ming Li

Journal of Molecular Modeling

DOI

2011

Theoretical investigation of Ni(PMe3)4-catalyzed intermolecular hydroacylation of alkynes with benzaldehydes

Qingxi Meng, Wei Shen, Rongxing He, Ming Li

Transition Metal Chemistry

DOI

2009

Density functional studies on copper-catalysed asymmetric aziridination of diazoacetate with imines

Fen Wang, Qingxi Meng, Ming Li

Molecular Simulation

DOI

2009

Mechanism of rhodium‐catalyzed hydroacylation of propylene using formaldehyde: A computational study

Fen Wang, Qingxi Meng, Ming Li

International Journal of Quantum Chemistry

DOI

2008

Density functional computations of Rh(I)-catalysed hydroacylation and hydrogenation of ethene using formic acid

Jigang Gao, Fen Wang, Qingxi Meng, Ming Li

Molecular Simulation

DOI

2008

Density functional computations of alkynylation of nitrones catalyzed by chiral zinc(II)-complexes

Fen Wang, Qingxi Meng, Jianmin Wang, Ming Li

Structural Chemistry

DOI

2008

Density functional computations of Rh(I)-catalysed hydroacylation of acetic aldehyde and ethene

Fen Wang, Qingxi Meng, Ming Li

Molecular Simulation

DOI

2007

Density functional computations of the cyclopropanation of ethene catalyzed by iron (II) carbene complexes Cp(CO)(L)FeCHR, L = CO, PMe3, R = Me, OMe, ph, CO2Me

Fen Wang, Qingxi Meng, Ming Li

International Journal of Quantum Chemistry

DOI

2007

Density functional computations of alkynylation of ethanimine catalyzed by chiral zinc(II)‐complexes

Qingxi Meng, Fen Wang, Ming Li

International Journal of Quantum Chemistry

DOI

2007

Theoretical insights of copper(I)–nitrene complexes

Qingxi Meng, Fen Wang, Xiangjin Qu, Jie Zhou, Ming Li

Journal of Molecular Structure THEOCHEM

DOI

2007

Theoretical insights of iron(II)–carbene complexes Cp(CO)(L)Fe CHR, L = CO, PMe3

Qingxi Meng, Fen Wang, Xiangjin Qu, Jie Zhou, Ming Li

Journal of Molecular Structure THEOCHEM

DOI

2006

Theoretical insights of copper(I) carbenes

Qingxi Meng, Ming Li

Journal of Molecular Structure THEOCHEM

DOI

2006

Density function studies on Cr(CO)3-catalyzed 1,3-dipolar cycloaddition of nitrone and alkene

Qingxi Meng, Ming Li

Journal of Molecular Structure THEOCHEM

DOI

2006

Density functional computations of enantioselective alkynylation of aldehyde catalyzed by chiral zinc(II)-complexes

Qingxi Meng, Ming Li, Jinsheng Zhang

Journal of Molecular Modeling

DOI

2006

Density function studies on the PtCl2‐catalyzed asymmetric cycloisomerization reaction of hydroxylated enynes

Qingxi Meng, Ming Li, Jinsheng Zhang, Wei Shen

International Journal of Quantum Chemistry

DOI

2005

CH（X2Π）与NH3反应机理的量子化学研究

张金生，孟庆喜，李明

《人工智能科学与工程》

DOI

2005

O（3P）与C2H2反应机理的量子化学研究

孟庆喜，张金生，申伟，罗小玲，李明

《人工智能科学与工程》

2005

FC（O）O自由基与NO2反应的量子化学研究

张金生，孟庆喜，李明

《化学学报》

2005

Cl原子与CH3OCH2Br反应机理的量子化学研究

翟巧玲，张金生，孟庆喜，李明

《人工智能科学与工程》

DOI

精选作品

期刊论文

Theoretical Investigations of Ni/( R , R )‐Me‐DuPhos‐Catalyzed Enantioselective Hydroalkoxylation of 1,3‐Dienes With Methanol

MestReNova和DeepSeek软件在波谱分析教学中的应用

《化学软件及应用》课程教学改革探索与实践

Theoretical study of Ni(0)-catalyzed intermolecular hydroamination of branched 1,3-dienes: reaction mechanism, regioselectivity, enantioselectivity, and prediction of the ligand

Theoretical investigations of Co-catalyzed allylic aminations

Comprehensive Theoretical Study of Cp*IrIII-Catalyzed Intermolecular Enantioselective Allylic C–H Amidation: Reaction Mechanism, Electronic Processes, and Regioselectivity

基础化学实验“小班化”教学的思考与尝试

Comprehensive theoretical study of nickel‐NHC‐catalyzed enantioselective intramolecular indole C—H cyclization: Reaction mechanism, reactivity, regioselectivity, and electronic processes

Theoretical Study of N–H σ-Bond Activation by Nickel(0) Complex: Reaction Mechanism, Electronic Processes, and Prediction of Better Ligand

Strategy Used to Control the Mechanism of Homogeneous Alkyne/Olefin Hydrogenation: AIMD Simulations and DFT Calculations

Theoretical Insight into Ni(0)-Catalyzed Hydroarylation of Alkenes and Arylboronic Acids

Phosphine ligand-coated Cu nanoparticle-catalyzed selective semihydrogenation of alkynes: electronic or hindrance effects of the ligand?

大数据背景下农林院校研究生化学信息基础课程教学改革探索与实践

Highly efficient blue-emitting of bis-cyclometalated tetravalent platinum (IV) complexes: A theoretical study

Density Functional Computations for Co(I)‐Catalyzed Intermolecular Hydroacylation of Benzaldehydes

Density functional calculations for Rh(I)‐catalyzed C–C bond activation of siloxyvinylcyclopropanes and diazoesters

What accounts for the color purity of tetradentate Pt complexes? A computational analysis

Small substituent groups as geometric controllers for tridentate platinum( ii ) complexes to effectively suppress non-radiative decay processes

提高《高等无机化学》“群论”教学质量的思考与尝试——量子化学计算方法及其相关软件的应用

Mechanism for Co(dppp)-catalyzed regioselective intermolecular hydroacylation of 1,3-dienes and benzaldehydes: Insights from density functional calculations

铜络合物手性催化羰基ene反应的密度泛函研究

提升《结构化学》教学质量的思考与尝试——多种教学方法的应用

Mechanism for ruthenium hydride-catalyzed regioselective hydroacylation of enones and aldehydes to give 1,3-diketones: Insights from density functional calculations

Theoretical Studies for Switching Regioselectivity in Ruthenium Hydride‐Catalyzed Alkyne Hydroacylation

《结构化学》教学中设置课程论文的思考与尝试

Mechanisms for nickel(0)/N-heterocyclic carbene-catalyzed intramolecular alkene hydroacylation: insights from a DFT study

Substituent effect and ligand exchange control the reactivity in ruthenium(II)-catalyzed hydroacylation of isoprenes and aldehydes ‖ A DFT study

Mechanisms and reactivity differences for the cobalt-catalyzed enantioselective intramolecular hydroacylation of ketones and alkenes: insights from density functional calculations

Theoretical studies of nickel-catalyzed ring-opening hydroacylation of methylenecyclopropanes and benzaldehydes

Theoretical studies of cobalt(I)-catalyzed hydroacylation of vinylsilanes and alkyl aldehydes

Theoretical studies of palladium-catalyzed cycloaddition of alkynyl aryl ethers and alkynes

Nickel/zinc-catalyzed decarbonylative addition of anhydrides to alkynes: A DFT study

Theoretical studies of ruthenium hydride-catalyzed addition reactions of benzaldehydes to isoprenes leading to β,γ-unsaturated ketones: The role of the ligands hydride, carbonyl, chloride, and triphenylphosphine of the catalyst

Theoretical investigation of Co(0)-catalyzed intramolecular hydroacylation of 4-pentenal

几种过渡金属催化酰化、环化反应的理论研究

Theoretical studies on the Mo-catalyzed asymmetric intramolecular Pauson-Khand-type [2 + 2 + 1] cycloadditions of 3-allyloxy-1-propynylphosphonates

Theoretical investigation of Ni(PMe3)4-catalyzed intermolecular hydroacylation of alkynes with benzaldehydes

Density functional studies on copper-catalysed asymmetric aziridination of diazoacetate with imines

Mechanism of rhodium‐catalyzed hydroacylation of propylene using formaldehyde: A computational study

Density functional computations of Rh(I)-catalysed hydroacylation and hydrogenation of ethene using formic acid

Density functional computations of alkynylation of nitrones catalyzed by chiral zinc(II)-complexes

Density functional computations of Rh(I)-catalysed hydroacylation of acetic aldehyde and ethene

Density functional computations of the cyclopropanation of ethene catalyzed by iron (II) carbene complexes Cp(CO)(L)FeCHR, L = CO, PMe3, R = Me, OMe, ph, CO2Me

Density functional computations of alkynylation of ethanimine catalyzed by chiral zinc(II)‐complexes

Theoretical insights of copper(I)–nitrene complexes

Theoretical insights of iron(II)–carbene complexes Cp(CO)(L)Fe CHR, L = CO, PMe3

Theoretical insights of copper(I) carbenes

Density function studies on Cr(CO)3-catalyzed 1,3-dipolar cycloaddition of nitrone and alkene

Density functional computations of enantioselective alkynylation of aldehyde catalyzed by chiral zinc(II)-complexes

Density function studies on the PtCl2‐catalyzed asymmetric cycloisomerization reaction of hydroxylated enynes

CH（X2Π）与NH3反应机理的量子化学研究

O（3P）与C2H2反应机理的量子化学研究

FC（O）O自由基与NO2反应的量子化学研究

Cl原子与CH3OCH2Br反应机理的量子化学研究

研究方向