Publications

2008    2007    2006    2005    2004    2003    2002 
2009    2010    2011    2012    2013    2014    201
2016
 
2014

 

1. Molecular Hydrogen Formation from Photocatalysis of Methanol on Anatase-TiO2(101)
徐晨彪,杨文绍,郭庆,戴东旭,陈茂笃,杨学明
Journal of the American Chemical Society

2. Isotope-Dependent Rotational States Distributions Enhanced by Dynamic Resonance States: A Comparison Study of the F plus HD -> HF(V-HF=2) + D and F + H-2 -> HF(V-HF=2) + H Reaction
汪涛,杨天罡,肖春雷,孙志刚,黄龙,戴东旭,杨学明,张东辉
Journal of Physical Chemistry Letters

3. Trapped Abstraction in the O(1D) + CHD3 → OH + CD3 Reaction
杨家岳,邵科杰,张冬,帅全,傅碧娜,张东辉,杨学明
Journal of Physical Chemistry Letters

4. How Is C?H Vibrational Energy Redistributed in F + CHD3(ν1 = 1) → HF + CD3?
杨家岳,张冬,姜波,戴东旭,吴国荣,张东辉,杨学明
Journal of Physical Chemistry Letters

5. Effect of antisymmetric C—H stretching excitation on the dynamics of O(1D) + CH4 → OH + CH3
潘慧琳,杨家岳,张冬,帅全,戴东旭,吴国荣,姜波,杨学明
Journal of Chemical Physics

6. State-to-state dynamics of the H?(n) + HD → D?(n) + H2 reactive scattering
俞盛锐,苏抒,戴东旭,袁开军,杨学明
Journal of Chemical Physics

7. Velocity Map Imaging Study of the Reaction Dynamics of the H + CH4 → H2 + CH3 Reaction: The Isotope Effects
潘慧琳,杨家岳,帅全,张冬,张未卿,吴国荣,戴东旭,姜波,张东辉,杨学明
Journal of Physical Chemistry A

8. Imaging the Pair-Correlated HNCO Photodissociation: The NH(a1Δ) + CO(X1Σ+) Channel
张志国,陈志超,黄存顺,陈旸,戴东旭,David H. Park,杨学明
Journal of Physical Chemistry A

9. Controlled Vacancy-Assisted C?C Couplings of Acetaldehyde on Rutile TiO2(110)
杨文绍,耿振华,徐晨彪,郭庆,戴东旭,杨学明
Journal of Physical Chemistry C

10. The role of water in photocatalytic dissociation of methanol on rutile TiO2(110)—(1 1)
徐晨彪,杨文绍,郭庆,戴东旭,陈茂笃,杨学明
Chinese Journal of Catalysis

11. Ion-Velocity Map Imaging Study of Photodissociation Dynamics of Acetaldehyde
张志国,陈志超,张翠梅,金艳玲,张群,陈旸,黄存顺,杨学明
Chinese Journal of Chemical Physics

12. Six-dimensional quantum dynamics study for the dissociative adsorption of DCl on Au(111) surface
刘天辉,傅碧娜,张东辉
Journal of Chemical Physics

13. Validity of the site-averaging approximation for modeling the dissociative chemisorption of H2 on Cu(111) surface: A quantum dynamics study on two potential energy surfaces
刘天辉,傅碧娜,张东辉
Journal of Chemical Physics

14. Communication: Separable potential energy surfaces from multiplicative artificial neural networks
Koch Werner,张东辉
Journal of Chemical Physics

15. Eight-dimensional quantum reaction rate calculations for the H+CH4 and H2+CH3 reactions on recent potential energy surfaces
周勇,张东辉
Journal of Chemical Physics

16. Effects of reagent rotational excitation on the H + CHD3 → H2 + CD3 reaction: A seven dimensional time-dependent wave packet study
张兆军,张东辉
Journal of Chemical Physics

17. Accuracy of the centrifugal sudden approximation in the H + CHD3 → H2 + CD3 reaction
张兆军,陈俊,刘舒,张东辉
Journal of Chemical Physics

18. Global Potential Energy Surface for the H+CH4 <-> H2+CH3 Reaction using Neural Networks
徐昕,陈俊,张东辉
Chinese Journal of Chemical Physics

19. Six-dimensional potential energy surface of the dissociative chemisorption of HCl on Au(111) using neural networks
刘天辉,傅碧娜,张东辉
Science China-Chemistry

20. State-to-state quantum versus classical dynamics study of the OH + CO → H + CO2 reaction in full dimensions (J = 0): checking the validity of the quasi?classical trajectory method
刘舒,陈俊,傅碧娜,张东辉
THEORETICAL CHEMISTRY ACCOUNTS

21. Efficient Fourth-Order Split Operator for Solving the Triatomic Reactive Schrodinger Equation in the Time-Dependent Wavepacket Approach
李文涛,张东辉,孙志刚
Journal of Physical Chemistry A

22. Calculation of state-to-state cross sections for triatomic reaction by the multi-configuration time-dependent Hartree method
赵斌,张东辉,Soo-Y.Lee ,孙志刚
Journal of Chemical Physics

23. Photoelectron imaging and theoretical study on the structure and chemical binding of the mixed-ligand M(I) complexes, [HMSH]? (M = Cu, Ag, and Au)
秦正波,刘志凌,从然,谢华,唐紫超,樊红军
Journal of Chemical Physics

24. Photoelectron Imaging and Theoretical Study on Nascent Hydrogen Bond Network in Microsolvated Clusters of Au?(CH3OH)n (n = 1?5)
秦正波,从然,谢华,刘志凌,吴侠,唐紫超,江凌,樊红军
Journal of Physical Chemistry A

25. An investigation into low-lying electronic states of HCS2 via threshold photoelectron imaging
秦正波,从然,刘志凌,谢华,唐紫超,樊红军
Journal of Chemical Physics

26. On the photoelectron velocity-map imaging of lutetium monoxide anion LuO?
刘志凌,谢华,李泉江,秦正波,从然,吴侠,唐紫超,樊红军
Journal of Chemical Physics

27. Direct, Nonoxidative Conversion of Methane to Ethylene, Aromatics, and Hydrogen
郭晓光,Guangzong Fang, 李刚, Hao Ma, 樊红军, Liang Yu, Chao Ma, Xing Wu, Dehui Deng, Mingming Wei, Dali Tan, Rui Si, Shuo Zhang, Jianqi Li, Litao Sun, 唐紫超, 潘秀莲, 包信和
SCIENCE

28. Complete State-Resolved Non-Adiabatic Dynamics of the O(3P) + D2 → OD(X2Π) + D Reaction
Sridhar A. Lahankar, Jianming Zhang, Timothy K. Minton, and Kenneth G. McKendrick
Journal of the American Chemical Society

29. Homogenous Pd-Catalyzed Asymmetric Hydrogenation of Unprotected Indoles: Scope and Mechanistic Studies
Ying Duan, 李璐, Mu-Wang Chen, 余长斌, 樊红军,周永贵
Journal of the American Chemical Society

30. Communication: Imaging the effects of the antisymmetric-stretching excitation in the O(3P) + CH4(v 3 = 1) reaction
潘慧琳,刘国平
Journal of Chemical Physics

31. Full-Dimensional Quantum State-to-State Nonadiabatic Dynamics for Photodissociation of Ammonia in its A?Band
Changjian Xie,Jianyi Ma,Xiaolei Zhu,张东辉,David R. Yarkony,谢代前,郭华
Journal of Physical Chemistry Letters

32. Slice imaging of methyl bromide photofragmentation at 193 nm
王凤燕, M. Laura Lipciuc, Andreas Kartakoullis, Pavle Glodic, Peter C. Samartzis, 杨学明, Theofanis N. Kitsopoulos
Physical Chemistry Chemical Physics

33. Quantum and quasi-classical dynamics of the OH + CO H + CO2 reaction on a new permutationally invariant neural network potential energy surface
李军,陈俊,张东辉,郭华
Journal of Chemical Physics

34. Calculation of the state-to-state S-matrix for tetra-atomic reactions with transition-state wave packets: H-2/D-2 + OH -> H/D + H2O/HOD
赵斌,孙志刚,郭华
Journal of Chemical Physics

35. Product fine-structure resolved photodissociation dynamics: The A band of H2O
周林森,谢代前,孙志刚,郭华
Journal of Chemical Physics

36. Calculation of state-to-state differential and integral cross sections for atom-diatom reactions with transition-state wave packets
赵斌,孙志刚,郭华
Journal of Chemical Physics

37. Communication: Rigorous quantum dynamics of O + O-2 exchange reactions on an ab initio potential energy surface substantiate the negative temperature dependence of rate coefficients
李亚琴,孙志刚,蒋彬,谢代前,Richard Dawes,郭华
Journal of Chemical Physics

38. Time-dependent quantum wave packet and quasiclassical trajectory studies of the Au(S-2) + H-2(X-1 n-ary sumation (+)(g)) -> AuH(X-1 n-ary sumation (+)(g)) + H(S-2) reaction
袁久闯,程大海,孙志刚,陈茂笃
MOLECULAR PHYSICS

39. Experimental and Theoretical Study on the Pyrolysis Mechanism of Three Coal-Based Model Compounds
李刚,李璐,史磊,靳立军,唐紫超,樊红军,胡浩权
Energy & Fuels

40. Experimental and Theoretical Investigation on Three α,ω-Diarylalkane Pyrolysis
李刚,李璐,Lijun Jin,唐紫超,樊红军,Haoquan Hu
ENERGY & FUELS

41. First-Principles Study of Methanol Oxidation into Methyl Formate on Rutile TiO2(110)
郎秀峰,闻波,周传耀,任泽峰,刘利民
Journal of Physical Chemistry C

42. Structural evolution of homoleptic heterodinuclear copper-nickel carbonyl anions revealed using photoelectron velocity-map imaging
刘志凌,谢华,秦正波,樊红军,唐紫超
Inorganic Chemistry

43. Internal Conversion versus Intersystem Crossing: What Drives the Gas Phase Dynamics of Cyclic α,β-Enones?
Oliver Schalk, Michael S. Schuurman, 吴国荣, Peter Lang, Melanie Mucke, Raimund Feifel, Albert Stolow
JOURNAL OF PHYSICAL CHEMISTRY A

44. Infrared Signature of the Early Stage Microsolvation in the NaSO4?(H2O)1?5 Clusters: A Simulation Study
金坦,张冰冰,宋建,江凌,丘怡申,庄巍
Journal of Physical Chemistry A

45. Coordination Number of Li+ in Nonaqueous Electrolyte Solutions Determined by Molecular Rotational Measurements
袁开军, 边洪涛,沈宇能,蒋博,李介博,张雨芳,陈海龙,郑俊荣
JOURNAL OF PHYSICAL CHEMISTRY B

46. Coriolis coupling effect of state-to-state quantum dynamics for He + HeH+
吴丹,郭明星,王云,尹淑慧,孙志刚,Mark R. Hoffmann
THEORETICAL CHEMISTRY ACCOUNTS

 


 

Copyright 2008-2013, Group 1102, DICP. All Rights Reserved.        
Contact Webmaster.