Qingyong Meng

发表

Revisiting the Gaussian process regression for fitting high-dimensional potential energy surface and its application to the OH + HO2→ O2 + H2O reaction.

Qingfei Song, Qingyong Meng, Qingfei Song, 2020, The Journal of chemical physics.

Rate coefficients of the H + H2O2 → H2 + HO2 reaction on an accurate fundamental invariant-neural network potential energy surface.

Dong H. Zhang, Bina Fu, Qingyong Meng, 2018, The Journal of chemical physics.

Ring polymer molecular dynamics fast computation of rate coefficients on accurate potential energy surfaces in local configuration space: Application to the abstraction of hydrogen from methane.

Qingyong Meng, Jun Chen, Dong H. Zhang, 2016, The Journal of chemical physics.

A theoretical model study on the cyclic reaction of 4-hydroxybutanal catalyzed by Brønsted acid

Qingyong Meng, M. Huang, Chenggen Zhang, 2009 .

Theoretical study on the predissociation mechanism of CO(2)(+) (C (2)Sigma(g)(+)).

Qingyong Meng, Hailong Chang, M. Huang, 2009, The journal of physical chemistry. A.

Unified Regression Model in Fitting Potential Energy Surfaces for Quantum Dynamics

Qingfei Song, Qiuyu Zhang, Qingyong Meng, 2022, Journal of Mathematical Chemistry.

Ring-polymer molecular dynamics study on rate coefficient of the barrierless OH + CO system at low temperature.

Jun Chen, Qingyong Meng, 2019, The Journal of chemical physics.

Unified Regression Model in Fitting Potential Energy Surfaces for Quantum Dynamics

Qingfei Song, Qiuyu Zhang, Qingyong Meng, 2022, Journal of Mathematical Chemistry.

Theoretical and experimental investigations of rate coefficients of O(1D) + CH4 at low temperature.

Dong H. Zhang, Kejie Shao, Qingyong Meng, 2016, Physical chemistry chemical physics : PCCP.

Multilayer Multiconfiguration Time-Dependent Hartree Study on the Mode-/Bond-Specific Quantum Dynamics of Water Dissociation on Cu(111).

Qingfei Song, Qiuyu Zhang, Qingyong Meng, 2022, The journal of physical chemistry. A.

Theoretical studies on N-loss predissociation mechanisms of N2O+ (A 2Σ+) in Cs symmetry

Hua Dong, Qingyong Meng, Hailong Chang, 2011 .

Mechanistic insight into the highly regioselective Ni(0)-catalyzed [2 + 2] self-cycloaddition of electron-deficient allenoates

Qingyong Meng, Qianqian Li, Lili Zhao, 2019, Catalysis Science & Technology.

Synthesis and characterization of a singlet delocalized 2,4-diimino-1,3-disilacyclobutanediyl and a silylenylsilaimine.

Shuhua Zhang, Qingyong Meng, K. Lim, 2012, Chemistry.

Thermal conductivity of polydisperse hexagonal BN / polyimide composites: Iterative EMT model and machine learning based on first principles investigation

Qingyong Meng, G. Qin, S. Chan, 2022, Chemical Engineering Journal.

A multilayer MCTDH study on the full dimensional vibronic dynamics of naphthalene and anthracene cations.

Hans-Dieter Meyer, Qingyong Meng, H. Meyer, 2013, The Journal of chemical physics.

Nonequilibrium Green’s function techniques in current–voltage calculations of nanoscale materials

Qingyong Meng, Zhiwen Yang, Chuanzheng Hu, 2012 .

Trajectory studies of the reaction F−+HCl→HF+Cl−. I. Reaction rate constant

Qingyong Meng, Timothy A. Su, J. Wei, 1995 .

A CAS study on S‐loss and O‐loss dissociation mechanisms of the SO2+ ion in the C, D, and E states

QINGYONG MENG, MING-BAO HUANG, Qingyong Meng, 2011, J. Comput. Chem..

Photodissociation mechanisms of the CO2(2+) dication studied using multi-state multiconfiguration second-order perturbation theory.

Zhiyuan Tian, Qingyong Meng, Bo‐Zhen Chen, 2013, The Journal of chemical physics.

A theoretical study on the mechanisms of the N2(X1 ) + O+(4Su) reaction involving the 14A″ and X2Π states of the N2O+ ion and the predissociation of the X2Π state

Hua Dong, Qingyong Meng, Hailong Chang, 2010 .

Computational study on the O- and Cl-loss dissociations of ClOO

Qingyong Meng, 2019, Chemical Physics.

Theoretical studies on the multiple metal–metal bonds in the bimetallic molecules and the ultrashort V–Mn bonds in the complexes

Hua Dong, Qingyong Meng, Yan-Bo Wu, 2012 .

Multiconfigurational study on the synchronous mechanisms of the ClO self-reaction leading to Cl or Cl2

Hua Dong, Qingyong Meng, Ming-Bao Huang, 2012, Theoretical Chemistry Accounts.

Communication: Rate coefficients of the H + CH4 → H2 + CH3 reaction from ring polymer molecular dynamics on a highly accurate potential energy surface.

Qingyong Meng, Jun Chen, Dong H. Zhang, 2015, The Journal of chemical physics.

High-Dimensional Quantum Dynamics Study on Excitation-Specific Surface Scattering Including Lattice Effects of a Five-Atom Surface Cell.

H. Meyer, Qingyong Meng, Markus Schröder, 2021, Journal of chemical theory and computation.

Neural-network potential energy surface with small database and high precision: A benchmark of the H + H2 system.

Qingfei Song, Qiuyu Zhang, Qingyong Meng, 2019, The Journal of chemical physics.

MCTDH study on the reactive scattering of the Cl + HD reaction based on the neural-networks potential energy surface

Qingyong Meng, 2017, Chemical Physics.

Lattice effects of surface cell: Multilayer multiconfiguration time-dependent Hartree study on surface scattering of CO/Cu(100)

H. Meyer, Qingyong Meng, 2017 .

Expansion Hamiltonian model for a diatomic molecule adsorbed on a surface: Vibrational states of the CO/Cu(100) system including surface vibrations.

H. Meyer, Qingyong Meng, 2015, The Journal of chemical physics.

A full-dimensional multilayer multiconfiguration time-dependent Hartree study on the ultraviolet absorption spectrum of formaldehyde oxide.

H. Meyer, Qingyong Meng, 2014, The Journal of chemical physics.

MCTDH study on vibrational states of the CO/Cu(100) system.

H. Meyer, Qingyong Meng, 2013, The Journal of chemical physics.

Full dimensional quantum-mechanical simulations for the vibronic dynamics of difluorobenzene radical cation isomers using the multilayer multiconfiguration time-dependent Hartree method.

Oriol Vendrell, Hans-Dieter Meyer, Qingyong Meng, 2012, The Journal of chemical physics.

Theoretical Chemistry Course for Students in Chemistry

Qingyong Meng, 2021, 2109.12552.

Ring-Polymer Molecular Dynamics with Coarse-Grained Treatment of the Rate Coefficients of Chlorine Atom Reactions with Methane, Ethane, and Propane.

Qingyong Meng, 2018, The journal of physical chemistry. A.

Direct Canonical-Polyadic-Decomposition of the Potential Energy Surface from Discrete Data by Decoupled Gaussian Process Regression.

Qingfei Song, Qingyong Meng, D. Peláez, 2022, The journal of physical chemistry letters.

Ring-polymer molecular dynamics studies on the rate coefficient of the abstraction channel of hydrogen plus ethane, propane, and dimethyl ether.

Jun Chen, Qingyong Meng, 2017, The Journal of chemical physics.

Ring-polymer molecular dynamics study on rate coefficients of hydrogen abstraction of methane: A reduced-dimensional model

Qingyong Meng, 2018, Chemical Physics Letters.