豆育升 :豆育升

更新时间:2024-09-21 08:34

豆育升,是一位出生于1953年12月的中国化学家,礼泉县人。他拥有博士学位,并且是一位教授和博士生导师。豆教授于1998年毕业于英国牛津大学化学系,并在1999年至2003年期间在美国宾夕法尼亚州立大学、德克萨斯A\u0026M大学以及普林斯顿大学进行博士后研究。他于2006年5月受聘为重庆邮电大学教授,并于2009年正式成为该校教授。目前,他是重庆邮电大学生物信息学研究所的主任。豆教授是国际知名的计算化学专家,主要从事光化学反应的动力学模拟和生物大分子激光解析模拟。他主持和参与了多项国内外重大课题,并在国际权威期刊上发表了70余篇论文,其中某些论文被引用次数超过120次。

人物介绍

豆育升1998年毕业于英国牛津大学化学系,获博士学位,1999年~2003年先后在美国宾夕法尼亚州立大学,德克萨斯A\u0026M大学以及普林斯顿大学进行博士后研究,2006年5月受聘为重庆邮电大学教授,2009年正式成为重庆邮电大学教授。现为重庆邮电大学生物信息学研究所主任。

豆教授是国际知名的计算化学专家,主要从事光化学反应的动力学模拟和生物大分子激光解析模拟。主持和参与国内外多项重大课题,已在国际权威期刊发表论文70余篇,其中某些论文被引用次数超过120次。

主要科研经历

研究方向

1、光化学反应的动力学模拟

2、生物大分子激光解析模拟

主持科研课题

国家自然科学基金,激光诱导光化学反应的计算机模拟(20773168),208.1---2010.12,总经费26万;

重庆市自然科学基金,生物分子光化学反应的计算机模拟(2006BB2367),2006.9---2008.9,总经费2.5万;

重庆市教委科学技术项目,生物大分子质谱分析的计算机模拟(KJ070506),2007.1---2008 .12,总经费2万;

重庆邮电大学自然科学基金项目,生物大分子质谱分析的计算机模拟(A2006-81),

2006.5---2009.5 ,总经费35.4 万;

教育部“春晖计划”项目,基于网络的光化学反应计算平台(Z2007-1-6301),总经费3万。

代表性论文

1 Why does trans-azobenzene have a smaller isomerization yield for pp* excitation than for np*excitation? S. Yuan, Y. Dou, Y. Wang, and Z. Wen, J. Phys. Chem. A, accepted.

2 Trans-Cis Photoisomerization of Azobenzene by n®p* Excitation: A Semiclassical 动力学 Study, S. Yuan, W. Wu, Y. Dou, J. Zhao, Chinese Chemical Letters, in press

3 Non-adiabatic simulation study of photoisomerization of azobenzene: detailed mechanism and load-resisting capacity, J. Shao, Y. Lei, Z. Wen, Y. Dou, Z. Wang, J. Chem. Phys. 129, 164111 (2008).

4 A Parallel Algorithm for Simulating Photochemical Reaction. Hongjian Li, Hong Tang, Shixin Sun, Yusheng Dou. IEEE Proceedings of the 2008 IFIP International Conference on Network and Parallel Computing (NPC 2008)/ISBN 978-0-7695-3354-4, 2008, pp 258-262.

5 Construction and Application of Linux Virtual Server Cluster for Scientific Computing. H. Tang, R. She, C. He, Y. Dou. IEEE Proceedings of the 2008 IFIP International Conference on Network and Parallel Computing (NPC 2008) /ISBN 978-0-7695-3354-4, 2008, pp 287-289.

6 Parallel Computing in Semiclassical 动力学 Simulation of Photochemical Reactions. Y. Dou, M. Bai, H. Li, H. Tang, IEEE Proceedings of the 2008 IFIP International Conference on Network and Parallel Computing (NPC 2008) /ISBN 978-0-7695-3354-4, 2008, pp 267-272.

7 Detailed 动力学 of the nonradiative deactivation of adenine: A semiclassical dynamics study, Y. Lei, S. Yuan, Y. Dou, Y. Wang, and Z. Wen, J. Phys. Chem. A, 112, 8497 (2008).

8 Ultrafast laser excitation and rotational de-excitation of cis-stilbene

Y. Dou, W. Wu, H, Tang, and R. E. Allen, Chem. Phys. 353, 104 (2008).

9 Dynamic simulation study on ultrafast excited-state torsional 动力学 of 9,9’-bianthryl (BA) in gas phase: Real-时间 observation of novel oscillation behavior with the torsional coordinate, G. J. Zhao, Y.U. Liu, K. L. Han, and Y. Dou, Chem. Phys. Lett. 455, 29 (2008).

10 Involvement of Excited Triplet State in the Photodissociation of 环丁烷,

Y. Lei, B. Suo, A. Li, Y. Dou, B. Y. Wang, and Z. Wen , Intern. J. Quant. Chem.

108, 789 (2008).

11 Ultrafast Excited-State 动力学 of Tetraphenylethylene Studied by Semiclassical Simulation, G. J. Zhao, K. L. Han, Y. B. Lei, and Y. Dou, J. Chem. Phys. 127, 094307 (2007).

12 Detailed Dynamics of the Photodissociation of 环丁烷, Y. Dou, Y. Lei, A. Li, Z. Wen, B. R. Torralva, G.V. Lo, and R. E. Allen , J .Phys .Chem. A, 111, 1133 (2007).

13 Effect of C-C-C Bond Bending on Photodissociation of Cyclobutane, Y. Dou, Y. Lei, A. Li, Z. Wen , Y. Wang, G.V. Lo, and R. E. Allen , Appl. Surf. Sci,253, 6400 (2007).

14 Ring Opening Reaction of 1,3-Cyclohexadiene Studied By Semiclassical 动力学 Simulation, Y. Dou, S. Yuan, G. V. Lo, Appl. Surf. Sci,253, 6404 (2007).

15 Potential 能量 Curves for the , , and states of C2 using MRCI and approximate CI methods, Anyang Li, Yubin Wang, Yusheng Dou, Zhenyi Wen, Science in China Series B, 50, 614 (2007).

16 Femtosecond-Scale of Photodissociation of Benzene, P. Sauer, R. H. Xie, Y. Dou, B. R. Torralva and R. E. Allen, J. Mod. Optic.,52, 2423 (2005).

17 Desolvation of Enkephalin-H2O Clusters Ejected from a Heated Film, Y. Dou, Chem. Phys. Lett, 416, 336 (2005).

18 The two electron molecular bond revisited: From Bohr Orbits to Two Center Orbitals, G. Chen, S. A. Chin, Y. Dou, K. A. Kapale, M. Kim, A. A. Svidzinsky, K. Urtekin, H. Xiong, M. O. Scully, Advances in Atomic, Molecular and Optical Physics,51, 93 (2005).

19 Semiclassical Quantum Simulation for Laser Induced 摩尔cular 动力学, Y. Dou, Recent Res. Devel. Physical Chem., Transworld Research Network, Trivandrum, India, 2004, 7, 185-206.

20 Response of Si and InSb to Ultrafast Laser Pulses, T. Dumitrica, A. Burzo, Y. Dou, and R. E. Allen, Physic Status Solidi B , 241, 2331 (2004).

21 Molecular Calculations with Two-Center Correlated Orbitals, M. O. Scully, R. E. Allen, Y. Dou, K. T. Kapale, M. Kim and G. Chen, Chem. Phys. Lett.389, 385 (2004).

22 动力学 of Photocyclization of Cis-Stilbene to Dihydrophenanthrene, Y. Dou and R. E. Roland, J. Mod. Optic.,51, 2495 (2004).

23 Interplay娱乐 of Electronic and Nuclear Degrees of Freedom in a Femtosecond-Scale Photochemical Reaction, Y. Dou and R. E. Allen, Chem. Phys. Lett.,392, 352, (2004).

24 Detailed 动力学 of a Complex Photochemical Reaction: Cis-Trans Photoisomerization of Stilbene, Y. Dou and R. E. Allen, J. Chem. Phys.119, 10658 (2003).

25 Detailed Mechanism for Trans-Cis Photoisomerization of Butadiene Following a Femtosecond-Scale Laser Pulse, Y. Dou, B. R. Torralva and R. E. Allen, J. Phys. Chem. A. 107, 8817 (2003).

26 Semiclassical Electron-Radiation-Ion 动力学 (SERID) and Cis-Trans Photoisomerization of Butadiene, Y. Dou, B. R. Torralva and R. E. Allen, J. Mod. Optic.,50, 2615 (2003).

27 Another Important Coordinate in Photoisomerization of Trans-Stilbene, Y. Dou and R. E. Roland, Chem. Phys. Lett.378, 323 (2003).

28 Laser Desorption Imaging of Proteins from Ice via UV Femtosecond Laser Pulses, J. I. Berry, S. Sun, Y. Dou and N. Winograd, Anal. Chem.75, 5146 (2003).

29 Substrate-Assisted Laser-Initiated Ejection of Proteins Embedded in 液态水 Film, Y. Dou, N. Winograd, B. J. Garrison and L. V. Zhigilei, J. Phys. Chem. B 107, 2362 (2003).

30 Explosive Boiling of Water Films Adjacent to Heated Surfaces: A Microscopic Description, Y. Dou, L. V. Zhigilei, N. Winograd and B. J. Garrison, J. Phys. Chem. A 105, 2748 (2001).

31 Desorption of Silver Atoms from Benzene-Covered Ag(111) by Energetic Ar+ Bombardment, C. A. Messerole, E.Vandeweert, Y. Dou, Z. Postawa, B. J. Garrison, and N. Winograd, Nucl. Instrum. Meth. B 180, 53 (2001).

32 Thickness Effects of 液态水 Overlayer on Its Explosive Evaporation at Heated Metal surfaces, Y. Dou, L. V. Zhigilei, Z. Postawa, N. Winograd and B. J. Garrison, Nucl. Instrum. Meth. B 180, 105 (2001).

33 Environment-Dependent Desorption of Benzene Molecules, C. A. Messerole, E.Vandeweert, Y. Dou, Z. Postawa and N. Winograd, Resonance Ionization Spectroscopy 2000, American Institute of Physics Conference, Series Number 584, 2000, p197.

34 Photoemission and STM Study of the Electronic Structure of Nb-Doped TiO2, D. Morris, Y. Dou, J. Rebane, C. E. J. Mitchell, R. G. Egdell, D. S. L. Law, A. Vittadini and M. Casarin, Phys. Rev. from DVL B 61, 13445 (2000).

35 State-Selective 能量 and Angular Resolved Detection of Neutral 物种 Ejected from KeV Ion Bombarded C6H6/Ag{111}, E. Vandeweert, C. A. Meserole, A. Sostarecz, Y. Dou, N, Winograd and Z. Postawa, Nucl. Instrum. Meth. B 161-165, 820 (2000).

36 An Experimental and Theoretical Investigation of the Electronic Structure of CdO, Y. Dou, R. G. Egdell, D. S. Law, G. Beamson, N. M. Harrison and B. G. Searle , J. Phys.: Condens. Mat.10, 8447 (1998).

37 N-type Doping in CdO Ceramics: A Study by EELS and Photoemission Spectroscopy, Y. Dou, R. G. Egdell, T. Walker, D. S. L. Law and G. Beamson, Surface Science398, 241 (1988).

38 The Nature of Bandgap States in V-doped TiO2: A Study by Resonant Photoemission, Phys. Rev. B 55, 16083 (1997).

39 Bandgap Shrinkage in n-Type Doped CdO Probed by Photoemission Spectroscopy, Y. Dou, T. Fishlock. R. G. Egdell, D. S. L. Law and G. Beamson, Phys. Rev. B (Rapid Communication) 55, R13381 (1997).

40 The Surface Properties of Cd2SnO4 Ceramics Doped with Both In and Sb: A Study by EELS and Photoemission Spectroscopy, Y. Dou and R. G. Egdell, surface Science377-379, 181 (1997).

41 Bandgap States at Reduced WO3(001) Surfaces: A Comparison Between STS and Resonant Photoemission, 类风湿性关节炎 Dixon,D. Morris, J. Williams, J. Rebane, Y. Dou, F.H. Jones, R.G. Egdell and S.W. Downes, Book of Extended Abstracts, S. Raaen and J. Bremer (Eds.) 1997, p. 110.

42 The Surface Properties of Indium Doped Cd2SnO4 Ceramics, A Study by EELS and Photoemission Spectroscopy, Y. Dou and R. G. Egdell, Surface Science372, 289 (1997).

43 Eels and Photoemission Study of Antimony-Doped Cd2SnO4 Ceramics, Y. Dou and R. G. Egdell, J. Mater. Chem.6 1369 (1996).

44 N-Type Doping in Cd2SnO4: A Study by EELS and Photoemission Spectroscopy, Y. Dou and R. G. Egdell, Phys. Rev. B 53 15405 (1996).

45 Molecular-Based Mixed Valence Ferrimagnets (XR4)FeIIFeIII(C2O4)3(X = N,P;

R = n-propyl, n-butyl, phenyl): Anomalous Negative Magnetisation in the Tetra- n-butylammonium Derivative, Corine Mathoniere, Simon G. Carling, Dou Yusheng and Peter Day , J. Chem. Soc. Chem. Comm., 1551, 1994.

46 The Electronic 能量 Levels of d3 configuration in C2v Symmetry Field and Analysis of Electronic Spectra of Co Ion, Dou Yusheng, Wen Zhenyi and Chang Di, Acta Chimica Sinica49, 665 (1991).

47 The Parameters of Angular Overlap Model, Dou Yusheng and Zhao Yuqing, Huaxue TongBao (化学) (11), 47 (1991).

48 Equations for Calculating Dq and B, Dou Yusheng, J. Chem. Educ.67, 134 (1990).

49 Calculation of Ligand Field Stabilisation 能量, Zhao Yuqing and Dou Yusheng, Huaxue TongBao (化学) (2), 39 (1990).

50 A New Approach of Constructing the Term 函数 of dn System, Yao Xiaoyi, Chang Di, Dou Yusheng and Wen Zhenyi, Chinese Journal of atomic and Molecular Physics7, 1366 (1990).

51 A Strong Field Approach to Electronic Spectra of Co(II) Complexes, Chang Di, Dou Yusheng and Wen Zhenyi, Chemical Research and Application2, 66 (1990).

52 A Strong Field Approach to Electronic Spectra of Pseudo-tetrahedral Co(II) Complexes, Dou Yusheng, Chang Di and Wen Zhenyi, Journal of Inorganic Chemistry6, 468 (1990).

53 The Study on the Rate and Mechanism of Extraction of Nd(III) by BPMPSD with Single Drop Method, Hu Yingxi, Dou Yusheng and Chen Peihang, Journal of Northwest University20, 181 (1990).

54 The Kinetics of Cu(II) by HDEHP, Hu Yingxi, Dou Yusheng and Chen Peihang, Journal of Northwest University20, 187 (1990).

55 Metal Complexes of 吡唑 物种 (III), Zhao Jianshe, Ren Youxian, Liu Yuanfa and Dou Yusheng, Journal of Northwest University20, 185 (1990).

56 Derivation of Ligand Field 函数 for Arbitrary Symmetry by Using the Angular Overlap Model, Dou Yusheng and Wen Zhenyi, Huaxue TongBao (Chemistry) (2), 43 (1989).

57 The Unitary Group Approach (UGA) to the Weak Field Model ( f n ions), Wen Zhenyi, Wang Yubin, Dou Yusheng and Liu Chaomeng, Journal of Northwest University19, 1 (1989).

58 Symmetry Functions Adapted to the Subgroup Chain U(7)ÊG2ÊSO(3)ÊG, Wen Zhenyi, Wang Yubin, Dou Yusheng and Liu Chaomeng, Theoretica Chimica Acta 76, 26 (1989). (SCI IDS Number: AZ646; Times Cited: 0)

59 AOM Analysis on Ligand Field Spectra of the Pyazole 物种 Complexes of Pseudo-Tetrahedral Co(II) ( C2v), Dou Yusheng, Ren Youxian, Zhao Jianshe and Liu Yuanfa, Chemical Journal of Chinese Universities10, 1156 (1989).

60 Unitary Group Calculation and Program for Strong Field Approach, Dou Yusheng, Wen Zhenyi, Liu Chaomeng, Wang Yubin and Chang Di, Chemical Journal of Chinese Universities10, 1229 (1989).

61 Comparison of Two Methods of Constructing Symmetry Adapted Wave Functions for d-orbitals, Liu Chaomeng, Dou Yusheng and Wen Zhenyi, Journal of Northwest University18, 1 (1988).

62 Application of Angular Overlap Model (II). Microcomputer Program for Calculating Magnetic Property of Transition Metal Compounds, Dou Yusheng, Qin Zibin and Liu Chaomeng, Journal of Northwest University18, 84 (1988).

63 The Unitary Group Approach (UGA) to the Weak Field Model ( d n ions), Wen Zhenyi, Wang Yubin, Dou Yusheng and Liu Chaomeng, Acta Physico-Chimica Sinica4, 566 (1988).

64 A Simple Method of Deriving the Relative 能量 Energy of d-orbitals in Transition Metal Compounds, Dou Yusheng and Zhao Yuqing, Huaxue TongBao (Chemistry) (11), 44 (1987).

65 Application of Angular Overlap Model (I). Microcomputer Program for Calculating Electronic Spectra of Transition Metal Compounds, Dou Yusheng and Qin Zibin, Journal of Inorganic 化学 (in Chinese) 3, 143 (1987).

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