复杂体系的动力学研究

Ø        凝聚相体系的量子动力学

Ø        光电功能有机纳米结构的理论研究

Ø        生物大分子构象变化的动力学

   

中国科学技术大学 --20001201 研究生毕业

   

   

[1] Dan, Xiaohan, Xu, Meng, Stockburger, J T, Ankerhold, J, Shi, Qiang. Efficient low-temperature simulations for fermionic reservoirs with the hierarchical equations of motion method: Application to the Anderson impurity model. PHYSICAL REVIEW B[J]. 2023, 107(19): http://dx.doi.org/10.1103/PhysRevB.107.195429.
[2] Leng, Xuan, Yan, Yaming, Zhu, Ruidan, Zou, Jiading, Zhang, Wenzhao, Shi, Qiang. Revealing Intermolecular Electronic and Vibronic Coherence with Polarization-Dependent Two-Dimensional Beating Maps. JOURNAL OF PHYSICAL CHEMISTRY LETTERS. 2023, 838-845, [3] Dan, Xiaohan, Shi, Qiang. Theoretical study of nonadiabatic hydrogen atom scattering dynamics on metal surfaces using the hierarchical equations of motion method. JOURNAL OF CHEMICAL PHYSICS[J]. 2023, 159(4): 044101-, http://dx.doi.org/10.1063/5.0155172.
[4] 陈嘉颖, 马彤梅, 白书明, 史强. 光敏化反应生成单线态氧的电子耦合计算及共分子轨道重叠描述. 化学物理学报[J]. 2022, 35(1): 219-226, http://lib.cqvip.com/Qikan/Article/Detail?id=7107044708.
[5] 幸韬, 李天楚, 柳燕莺, 史强. 基于相空间级联运动方程的混合量子经典反应速率理论. 化学物理学报(英文). 2022, 35(5): 727-737, http://lib.cqvip.com/Qikan/Article/Detail?id=7108327445.
[6] Xu, Meng, Yan, Yaming, Shi, Qiang, Ankerhold, J, Stockburger, J T. Taming quantum noise for efficient low temperature simulations of open quantum systems. PHYSICAL REVIEW LETTERS[J]. 2022, http://arxiv.org/abs/2202.04059.
[7] Dan, Xiaohan, Xu, Meng, Yan, Yaming, Shi, Qiang. Generalized master equation for charge transport in a molecular junction: Exact memory kernels and their high order expansion. JOURNAL OF CHEMICAL PHYSICS[J]. 2022, 156(13): http://dx.doi.org/10.1063/5.0086663.
[8] 幸韬, 李天楚, 柳燕莺, 史强. Mixed Quantum Classical Reaction Rates based on the Phase Space Formulation of the Hierarchical Equations of Motion. 化学物理学报[J]. 2022, 35(5): 727-737, [9] Xing, Tao, Li, Tianchu, Yan, Yaming, Bai, Shuming, Shi, Qiang. Application of the imaginary time hierarchical equations of motion method to calculate real time correlation functions. JOURNAL OF CHEMICAL PHYSICS[J]. 2022, 156(24): http://dx.doi.org/10.1063/5.0095790.
[10] Bao, Peng, Hettich, Christian P, Shi, Qiang, Gao, Jiali. Block-Localized Excitation for Excimer Complex and Diabatic Coupling. JOURNAL OF CHEMICAL THEORY AND COMPUTATION[J]. 2021, 17(1): 240-254, http://dx.doi.org/10.1021/acs.jctc.0c01015.
[11] Liu, Yanying, Yan, Yaming, Xing, Tao, Shi, Qiang. Understanding the Large Kinetic Isotope Effect of Hydrogen Tunneling in Condensed Phases by Using Double-Well Model Systems. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2021, 125(22): 5959-5970, http://dx.doi.org/10.1021/acs.jpcb.1c02851.
[12] Yan, Yaming, Liu, Yanying, Xing, Tao, Shi, Qiang. Theoretical study of excitation energy transfer and nonlinear spectroscopy of photosynthetic light-harvesting complexes using the nonperturbative reduced dynamics method. WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCEnull. 2021, 11(3): http://dx.doi.org/10.1002/wcms.1498.
[13] Yan, Yaming, Xu, Meng, Li, Tianchu, Shi, Qiang. Efficient propagation of the hierarchical equations of motion using the Tucker and hierarchical Tucker tensors. JOURNAL OF CHEMICAL PHYSICS[J]. 2021, 154(19): http://dx.doi.org/10.1063/5.0050720.
[14] Ediger, Mark D, Jensen, Lasse, Manolopoulos, David E, Martinez, Todd J, Michaelides, Angelos, Reichman, David R, Sherrill, C David, Shi, Qiang, Straub, John E, Vega, Carlos, Wang, LaiSheng, Brigham, Erinn C, Lian, Tianquan. JCP Emerging Investigator Special Collection 2019. JOURNAL OF CHEMICAL PHYSICSnull. 2020, 153(11): http://dx.doi.org/10.1063/5.0021946.
[15] Zhu, Weigang, Zhang, Dezhong, Bai, Shuming, Shi, Qiang, Hu, Wenping, Fu, Hongbing. Template-Assisted Electrochemical Deposition for Organic and Hybrid Nanowire Electronics. ADVANCED OPTICAL MATERIALS[J]. 2020, 8(18): https://www.webofscience.com/wos/woscc/full-record/WOS:000545401800001.
[16] Yan, Yaming, Xing, Tao, Shi, Qiang. A new method to improve the numerical stability of the hierarchical equations of motion for discrete harmonic oscillator modes. JOURNAL OF CHEMICAL PHYSICS[J]. 2020, 153(20): http://dx.doi.org/10.1063/5.0027962.
[17] Zhu, Weigang, Sun, Yajing, Liu, Jie, Bai, Shuming, Zhang, Zhicheng, Shi, Qiang, Hu, Wenping, Fu, Hongbing. Exciton Transport in Molecular Semiconductor Crystals for Spin-Optoelectronics Paradigm. CHEMISTRY-A EUROPEAN JOURNAL. 2020, 27(1): https://www.webofscience.com/wos/woscc/full-record/WOS:000596562000001.
[18] Yan, Yaming, Xu, Meng, Liu, Yanying, Shi, Qiang. Theoretical study of charge carrier transport in organic molecular crystals using the Nakajima-Zwanzig-Mori generalized master equation. JOURNAL OF CHEMICAL PHYSICS[J]. 2019, 150(23): [19] Zhou, HeYe, Han, Ying, Shi, Qiang, Chen, ChuanFeng. A Triply Operable Molecular Switch: Anion-, Acid/Base- and Solvent-Responsive 2Rotaxane. EUROPEAN JOURNAL OF ORGANIC CHEMISTRY[J]. 2019, 2019(21): 3406-3411, https://www.webofscience.com/wos/woscc/full-record/WOS:000471077100011.
[20] Xu, Yang, Bao, Peng, Song, Kai, Shi, Qiang. Theoretical Study of Proton Coupled Electron Transfer Reaction in the Light State of the AppA BLUF Photoreceptor. JOURNAL OF COMPUTATIONAL CHEMISTRY[J]. 2019, 40(9): 1005-1014, https://www.webofscience.com/wos/woscc/full-record/WOS:000459346700007.
[21] Xu, Meng, Liu, Yanying, Song, Kai, Shi, Qiang. A non-perturbative approach to simulate heterogeneous electron transfer dynamics: Effective mode treatment of the continuum electronic states. JOURNAL OF CHEMICAL PHYSICS[J]. 2019, 150(4): [22] Li, Jing, Shi, Qiang, Han, Ying, Chen, ChuanFeng. Complexation of 2,6-helic6arene and its derivatives with 1,1 '-dimethyl-4,4 '-bipyridinium salts and protonated 4,4 '-bipyridinium salts: an acid-base controllable complexation. BEILSTEIN JOURNAL OF ORGANIC CHEMISTRY[J]. 2019, 15(1): 1795-1804, https://doaj.org/article/d1f4947785c5400495a1f327ec049bd8.
[23] Shi Qiang. Exact generator and its high order expansions in time-convolutionless generalized master equation: Applications to spin-boson model and excitation energy transfer. Chin. J. Chem. Phys.. 2018, [24] Shi, Qiang, Meng, Zheng, Xiang, JunFeng, Chen, ChuanFeng. Efficient control of movement in non-photoresponsive molecular machines by a photo-induced proton-transfer strategy. CHEMICAL COMMUNICATIONS[J]. 2018, 54(28): 3536-3539, https://www.webofscience.com/wos/woscc/full-record/WOS:000429024000027.
[25] Yan Yaming, Song Linze, Shi Qiang. Understanding the free energy barrier and multiple timescale dynamics of charge separation in organic photovoltaic cells.. THE JOURNAL OF CHEMICAL PHYSICS. 2018, [26] Sun, MengJia, Liu, Yingying, Yan, Yaming, Li, Rui, Shi, Qiang, Zhao, Yong Sheng, Zhong, YuWu, Yao, Jiannian. In Situ Visualization of Assembly and Photonic Signal Processing in a Triplet Light-Harvesting Nanosystem. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY[J]. 2018, 140(12): 4269-4278, http://dx.doi.org/10.1021/jacs.7b12519.
[27] Xu, Meng, Yan, Yaming, Liu, Yanying, Shi, Qiang. Convergence of high order memory kernels in the Nakajima-Zwanzig generalized master equation and rate constants: Case study of the spin-boson model. JOURNAL OF CHEMICAL PHYSICS[J]. 2018, 148(16): http://dx.doi.org/10.1063/1.5022761.
[28] Shi, Qiang, Xu, Yang, Yan, Yaming, Xu, Meng. Efficient propagation of the hierarchical equations of motion using the matrix product state method. JOURNAL OF CHEMICAL PHYSICS[J]. 2018, 148(17): https://www.webofscience.com/wos/woscc/full-record/WOS:000431685500004.
[29] Xu, Yang, Song, Kai, Shi, Qiang. Mixed quantum-classical simulation of the hydride transfer reaction catalyzed by dihydrofolate reductase based on a mapped system-harmonic bath model. JOURNAL OF CHEMICAL PHYSICS[J]. 2018, 148(10): https://www.webofscience.com/wos/woscc/full-record/WOS:000427517200026.
[30] Leng, Xuan, Yan, YaMing, Zhu, RuiDan, Song, Kai, Weng, YuXiang, Shi, Qiang. Simulation of the Two-Dimensional Electronic Spectroscopy and Energy Transfer Dynamics of Light-Harvesting Complex II at Ambient Temperature. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2018, 122(17): 4642-4652, https://www.webofscience.com/wos/woscc/full-record/WOS:000431723800004.
[31] 闫亚明, 包鹏, 史强. 关于自主知识产权计算化学软件发展的一些思考. 中国科学基金[J]. 2018, 32(1): 107-108, http://lib.cqvip.com/Qikan/Article/Detail?id=674403042.
[32] Zheng, Renhui, Wei, Wenmei, Xu, Meng, Shi, Qiang. Sum-frequency vibrational spectroscopy of limonene chiral liquids due to the nonadiabatic effect. PHYSICAL CHEMISTRY CHEMICAL PHYSICS[J]. 2018, 20(10): 7053-7058, [33] Leng, Xuan, Yue, Shuai, Weng, YuXiang, Song, Kai, Shi, Qiang. Effects of finite laser pulse width on two-dimensional electronic spectroscopy. CHEMICAL PHYSICS LETTERS[J]. 2017, 667: 79-86, http://dx.doi.org/10.1016/j.cplett.2016.11.030.
[34] Xu, Meng, Song, Linze, Song, Kai, Shi, Qiang. Convergence of high order perturbative expansions in open system quantum dynamics. JOURNAL OF CHEMICAL PHYSICS[J]. 2017, 146(6): https://www.webofscience.com/wos/woscc/full-record/WOS:000394577400002.
[35] Li, Wenqiang, Zhu, Lili, Shi, Qiang, Ren, Jiajun, Peng, Qian, Shuai, Zhigang. Excitonic coupling effect on the nonradiative decay rate in molecular aggregates: Formalism and application. CHEMICAL PHYSICS LETTERS[J]. 2017, 683: 507-514, http://dx.doi.org/10.1016/j.cplett.2017.03.077.
[36] Song, Kai, Shi, Qiang. Theoretical study of photoinduced proton coupled electron transfer reaction using the non-perturbative hierarchical equations of motion method. JOURNAL OF CHEMICAL PHYSICS[J]. 2017, 146(18): https://www.webofscience.com/wos/woscc/full-record/WOS:000401368900011.
[37] Song, Linze, Shi, Qiang. Hierarchical equations of motion method applied to nonequilibrium heat transport in model molecular junctions: Transient heat current and high-order moments of the current operator. PHYSICAL REVIEW B[J]. 2017, 95(6): https://www.webofscience.com/wos/woscc/full-record/WOS:000394657300007.
[38] Zhang, GengWu, Shi, Qiang, Chen, ChuanFeng. Formation of charge-transfer complexes based on a tropylium cation and 2,6-helic6arenes: a visible redox stimulus-responsive process. CHEMICAL COMMUNICATIONS[J]. 2017, 53(17): 2582-2585, https://www.webofscience.com/wos/woscc/full-record/WOS:000395873100012.
[39] Shi, Qiang, Han, Ying, Chen, ChuanFeng. Complexation Between (O-Methyl)(6)-2,6-Helic6arene and Tertiary Ammonium Salts: Acid/Base- or Chloride-Ion-Responsive Host-Guest Systems and Synthesis of 2Rotaxane. CHEMISTRY-AN ASIAN JOURNAL[J]. 2017, 12(19): 2576-2582, https://www.webofscience.com/wos/woscc/full-record/WOS:000412325700014.
[40] Zhao, Weiwei, Song, Kai, Chen, Yao, Wang, Hua, Liu, Zhang, Shi, Qiang, Huang, Jianbin, Wang, Yilin. Aggregation of a Cationic Gemini Surfactant with a Chelating Molecule and Effects from Calcium Ions. LANGMUIR[J]. 2017, 33(44): 12719-12728, http://dx.doi.org/10.1021/acs.langmuir.7b03137.
[41] Zhu, Weigang, Zhu, Lingyun, Zou, Ye, Wu, Yishi, Zhen, Yonggang, Dong, Huanli, Fu, Hongbing, Wei, Zhixiang, Shi, Qiang, Hu, Wenping. Deepening Insights of Charge Transfer and Photophysics in a Novel Donor-Acceptor Cocrystal for Waveguide Couplers and Photonic Logic Computation. ADVANCED MATERIALS[J]. 2016, 28(28): 5954-+, http://dx.doi.org/10.1002/adma.201600280.
[42] Song, Kai, Bai, Shuming, Shi, Qiang. Effect of Pulse Shaping on Observing Coherent Energy Transfer in Single Light-Harvesting Complexes. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2016, 120(45): 11637-11643, [43] Xie, Weiwei, Xu, Meng, Bai, Shuming, Shi, Qiang. Mixed Quantum-Classical Study of Nonadiabatic Curve Crossing in Condensed Phases. JOURNAL OF PHYSICAL CHEMISTRY A[J]. 2016, 120(19): 3225-3232, https://www.webofscience.com/wos/woscc/full-record/WOS:000376417300030.
[44] 宋凯, 徐扬, 宋林泽, 史强. 凝聚相质子转移反应的量子动力学理论. 中国科学. 化学[J]. 2016, 46(10): 1039-1049, https://www.sciengine.com/doi/10.1360/N032016-00086.
[45] Shi Qiang. An alternative realization of the exact non-Markovian stochastic Schrödinger equation. J. Chem. Phys.. 2016, [46] Meng, Zheng, Wang, BoYang, Xiang, JunFeng, Shi, Qiang, Chen, ChuanFeng. Self-Assembly of a 2Pseudorotaxane by an Inchworm-Motion Mechanism. CHEMISTRY-A EUROPEAN JOURNAL[J]. 2016, 22(42): 15075-15084, [47] Zhao, YanXia, Li, XiaoNa, Yuan, Zhen, Liu, QingYu, Shi, Qiang, He, ShengGui. Methane activation by gold-doped titanium oxide cluster anions with closed-shell electronic structures. CHEMICAL SCIENCE[J]. 2016, 7(7): 4730-4735, https://www.webofscience.com/wos/woscc/full-record/WOS:000378715000095.
[48] Zheng, Renhui, Wei, Wenmei, Sun, Yuanyuan, Song, Kai, Shi, Qiang. Theoretical study of vibrational energy transfer of free OH groups at the water-air interface. JOURNAL OF CHEMICAL PHYSICS[J]. 2016, 144(14): https://www.webofscience.com/wos/woscc/full-record/WOS:000374774000040.
[49] Welsch, Ralph, Song, Kai, Shi, Qiang, Althorpe, Stuart C, Miller, Thomas F, III. Non-equilibrium dynamics from RPMD and CMD. JOURNAL OF CHEMICAL PHYSICS[J]. 2016, 145(20): https://www.webofscience.com/wos/woscc/full-record/WOS:000390118200020.
[50] Song, Kai, Bai, Shuming, Shi, Qiang. A time domain two-particle approximation to calculate the absorption and circular dichroism line shapes of molecular aggregates. JOURNAL OF CHEMICAL PHYSICS[J]. 2015, 143(6): http://ir.iccas.ac.cn/handle/121111/27659.
[51] Song, Linze, Shi, Qiang. Calculation of correlated initial state in the hierarchical equations of motion method using an imaginary time path integral approach. JOURNAL OF CHEMICAL PHYSICS[J]. 2015, 143(19): http://dx.doi.org/10.1063/1.4935799.
[52] Yuan-yuan Jing, Kai Song, Shu-ming Bai, Qiang Shi. Linear and Nonlinear Spectra in Photosynthetic Light Harvesting Complexes: Benchmark Tests of Modified Redfield Method. 化学物理学报[J]. 2015, 28(4): 431-439, http://lib.cqvip.com/Qikan/Article/Detail?id=Wd728887768866504849534852484857.
[53] Zhu, Weigang, Zheng, Renhui, Fu, Xiaolong, Fu, Hongbing, Shi, Qiang, Zhen, Yonggang, Dong, Huanli, Hu, Wenping. Revealing the Charge-Transfer Interactions in Self-Assembled Organic Cocrystals: Two-Dimensional Photonic Applications. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION[J]. 2015, 54(23): 6785-6789, http://dx.doi.org/10.1002/anie.201501414.
[54] Zheng, Renhui, Wei, Wenmei, Shi, Qiang. A theoretical study of sum-frequency generation for chiral solutions near electronic resonance. PHYSICAL CHEMISTRY CHEMICAL PHYSICS[J]. 2015, 17(31): 20296-20300, http://ir.iccas.ac.cn/handle/121111/27792.
[55] Jing, Yuanyuan, Song, Kai, Bai, Shuming, Shi, Qiang. Linear and Nonlinear Spectra in Photosynthetic Light Harvesting Complexes: Benchmark Tests of Modified Redfield Method. CHINESE JOURNAL OF CHEMICAL PHYSICS[J]. 2015, 28(4): 431-439, http://lib.cqvip.com/Qikan/Article/Detail?id=Wd728887768866504849534852484857.
[56] Zheng, Renhui, Wei, Wenmei, Shi, Qiang. Theoretical investigation of quadrupole contributions to surface sum-frequency vibrational spectroscopy. PHYSICAL CHEMISTRY CHEMICAL PHYSICS[J]. 2015, 17(14): 9068-9073, http://dx.doi.org/10.1039/c4cp05347h.
[57] Liu, Yang, Liu, Hao, Song, Kai, Xu, Yang, Shi, Qiang. Theoretical Study of Proton Coupled Electron Transfer Reactions: The Effect of Hydrogen Bond Bending Motion. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2015, 119(25): 8104-8114, http://ir.iccas.ac.cn/handle/121111/27908.
[58] Bai, Shuming, Song, Kai, Shi, Qiang. Effects of Different Quantum Coherence on the Pump-Probe Polarization Anisotropy of Photosynthetic Light-Harvesting Complexes: A Computational Study. JOURNAL OF PHYSICAL CHEMISTRY LETTERS[J]. 2015, 6(10): 1954-1960, http://ir.iccas.ac.cn/handle/121111/28126.
[59] Nie, HaiJing, Yang, WenWen, Zheng, RenHui, Shi, Qiang, Chen, Hui, Yao, Jiannian, Zhong, YuWu. Metal Chelation-Assisted Amine-Amine Electronic Coupling through the 4,4 '-Positions of 2,2 '-Bipyridine. INORGANIC CHEMISTRY[J]. 2015, 54(4): 1272-1282, http://dx.doi.org/10.1021/ic5024967.
[60] Wang, Xuedong, Liao, Qing, Li, Hui, Bai, Shuming, Wu, Yishi, Lu, Xiaomei, Hu, Huaiyuan, Shi, Qiang, Fu, Hongbing. Near-Infrared Lasing from Small-Molecule Organic Hemispheres. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY[J]. 2015, 137(29): 9289-9295, http://ir.iccas.ac.cn/handle/121111/27794.
[61] Zhu, Weigang, Zheng, Renhui, Zhen, Yonggang, Yu, Zhenyi, Dong, Huanli, Fu, Hongbing, Shi, Qiang, Hu, Wenping. Rational Design of Charge-Transfer Interactions in Halogen-Bonded Co-crystals toward Versatile Solid-State Optoelectronics. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY[J]. 2015, 137(34): 11038-11046, http://dx.doi.org/10.1021/jacs.5b05586.
[62] Song, Linze, Shi, Qiang. A new approach to calculate charge carrier transport mobility in organic molecular crystals from imaginary time path integral simulations. JOURNAL OF CHEMICAL PHYSICS[J]. 2015, 142(17): http://ir.iccas.ac.cn/handle/121111/28007.
[63] Bai, Shuming, Xie, Weiwei, Zhu, Lili, Shi, Qiang. Calculation of absorption spectra involving multiple excited states: Approximate methods based on the mixed quantum classical Liouville equation. JOURNAL OF CHEMICAL PHYSICS[J]. 2014, 140(8): https://www.webofscience.com/wos/woscc/full-record/WOS:000332485900007.
[64] Liao, Qing, Xu, Zhenzhen, Zhong, Xiaolan, Dang, Wei, Shi, Qiang, Zhang, Chao, Weng, Yuxiang, Li, Zhiyuan, Fu, Hongbing. An organic nanowire waveguide exciton-polariton sub-microlaser and its photonic application. JOURNAL OF MATERIALS CHEMISTRY C[J]. 2014, 2(15): 2773-2778, http://ir.iphy.ac.cn/handle/311004/59222.
[65] Xie, Weiwei, Xu, Yang, Zhu, Lili, Shi, Qiang. Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes. JOURNAL OF CHEMICAL PHYSICS[J]. 2014, 140(17): https://www.webofscience.com/wos/woscc/full-record/WOS:000336048000007.
[66] Bai, Shuming, Xie, Weiwei, Shi, Qiang. A New Trajectory Branching Approximation To Propagate the Mixed Quantum-Classical Liouville Equation. JOURNAL OF PHYSICAL CHEMISTRY A[J]. 2014, 118(39): 9262-9271, https://www.webofscience.com/wos/woscc/full-record/WOS:000342651200042.
[67] Zheng, RenHui, Wei, WenMei, Liu, Hao, Jing, YuanYuan, Wang, BoYang, Shi, Qiang. Theoretical study of sum-frequency vibrational spectroscopy on limonene surface. JOURNAL OF CHEMICAL PHYSICS[J]. 2014, 140(10): https://www.webofscience.com/wos/woscc/full-record/WOS:000334120300047.
[68] 廖清, 徐珍珍, 钟晓兰, 党伟, 史强, 钟超, 翁羽翔, 李志远, 付红兵. An organic nanowire waveguide exciton-polariton sub-microlaser and its photonic application. J. MATER. CHEM. C[J]. 2014, 2(1): 2773-2778, http://ir.iccas.ac.cn/handle/121111/28760.
[69] Liu, Hao, Zhu, Lili, Bai, Shuming, Shi, Qiang. Reduced quantum dynamics with arbitrary bath spectral densities: Hierarchical equations of motion based on several different bath decomposition schemes. JOURNAL OF CHEMICAL PHYSICS[J]. 2014, 140(13): https://www.webofscience.com/wos/woscc/full-record/WOS:000334577300007.
[70] Zheng, Renhui, Wei, Wenmei, Zhu, Lili, Shi, Qiang. Theoretical study of the resonance Raman spectra for meso-tetrakis(3,5-di-tertiarybutylphenyl)-porphyrin. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY[J]. 2014, 133: 707-713, http://dx.doi.org/10.1016/j.saa.2014.06.047.
[71] Tang, Ailing, Lu, Zhenhuan, Bai, Shuming, Huang, Jianhua, Chen, Yuxia, Shi, Qiang, Zhan, Chuanlang, Yao, Jiannian. Photocurrent Enhancement in Diketopyrrolopyrrole Solar Cells by Manipulating Dipolar Anchoring Terminals on Alkyl-Chain Spacers. CHEMISTRY-AN ASIAN JOURNAL[J]. 2014, 9(3): 883-892, https://www.webofscience.com/wos/woscc/full-record/WOS:000331611900028.
[72] Zheng, Renhui, Wei, Wenmei, Jing, Yuanyuan, Liu, Hao, Shi, Qiang. Theoretical Study of Doubly Resonant Sum-Frequency Vibrational Spectroscopy for 1,1 '-Bi-2-naphthol Molecules on Water Surface. JOURNALOFPHYSICALCHEMISTRYC[J]. 2013, 117(21): 11117-11123, https://www.webofscience.com/wos/woscc/full-record/WOS:000319896700027.
[73] 詹传郎, 姚建年, 白书明, 黄剑华, 陈玉霞, 史强. Photocurrent enhancement in diketopyrrolopyrrole solar cells by manipulating dipolar anchoring terminals on alkyl-chain spacers. CHEM. ASIAN J[J]. 2013, 9(3): 883-892, http://ir.iccas.ac.cn/handle/121111/28795.
[74] Wu, Kui, Liu, Suyan, Luo, Qun, Hu, Wenbing, Li, Xianchan, Wang, Fuyi, Zheng, Renhui, Cui, Jie, Sadler, Peter J, Xiang, Junfeng, Shi, Qiang, Xiong, Shaoxiang. Thymines in Single-Stranded Oligonucleotides and G-Quadruplex DNA Are Competitive with Guanines for Binding to an Organoruthenium Anticancer Complex. INORGANIC CHEMISTRY[J]. 2013, 52(19): 11332-11342, http://dx.doi.org/10.1021/ic401606v.
[75] Yao, ChangJiang, Zheng, RenHui, Nie, HaiJing, Cui, BinBin, Shi, Qiang, Yao, Jiannian, Zhong, YuWu. A Combined Experimental and Computational Study of Linear Ruthenium(II) Coordination Oligomers with End-Capping Organic Redox Sites: Insight into the Light Absorption and Charge Delocalization. CHEMISTRY-A EUROPEAN JOURNAL[J]. 2013, 19(37): 12376-12387, https://www.webofscience.com/wos/woscc/full-record/WOS:000323731200029.
[76] Xie, Weiwei, Bai, Shuming, Zhu, Lili, Shi, Qiang. Calculation of Electron Transfer Rates Using Mixed Quantum Classical Approaches: Nonadiabatic Limit and Beyond. JOURNAL OF PHYSICAL CHEMISTRY A[J]. 2013, 117(29): 6196-6204, https://www.webofscience.com/wos/woscc/full-record/WOS:000322503200035.
[77] Shi Qiang, Chen Hui. Theoretical methods for excited state dynamics of molecules and molecular aggregates. SCIENCE CHINA-CHEMISTRY[J]. 2013, 56(9): 1271-1276, https://www.webofscience.com/wos/woscc/full-record/WOS:000323505300019.
[78] Zhu, Lili, Liu, Hao, Shi, Qiang. A new method to account for the difference between classical and quantum baths in quantum dissipative dynamics. NEW JOURNAL OF PHYSICS[J]. 2013, 15(9): https://www.webofscience.com/wos/woscc/full-record/WOS:000324911100001.
[79] Jing, Yuanyuan, Chen, Liping, Bai, Shuming, Shi, Qiang. Equilibrium excited state and emission spectra of molecular aggregates from the hierarchical equations of motion approach. JOURNAL OF CHEMICAL PHYSICS[J]. 2013, 138(4): https://www.webofscience.com/wos/woscc/full-record/WOS:000314725900063.
[80] Zhang, Xin, Lu, Zhenhuan, Ye, Long, Zhan, Chuanlang, Hou, Jianhui, Zhang, Shaoqing, Jiang, Bo, Zhao, Yan, Huang, Jianhua, Zhang, Shanlin, Liu, Yang, Shi, Qiang, Liu, Yunqi, Yao, Jiannian. A Potential Perylene Diimide Dimer-Based Acceptor Material for Highly Efficient Solution-Processed Non-Fullerene Organic Solar Cells with 4.03% Efficiency. ADVANCED MATERIALS[J]. 2013, 25(40): 5791-+, https://www.webofscience.com/wos/woscc/full-record/WOS:000330773400016.
[81] Shuai ZhiGang, Liu WenJian, Liang WanZhen, Shi Qiang, Chen Hui. Theoretical study of the low-lying electronic excited states for molecular aggregates. SCIENCE CHINA-CHEMISTRY[J]. 2013, 56(9): 1258-1262, https://www.webofscience.com/wos/woscc/full-record/WOS:000323505300016.
[82] Shi, Guojun, Wang, Yue, Jin, Yi, Chi, Shaoming, Shi, Qiang, Ge, Maofa, Wang, Shu, Zhang, Xingkang, Xu, Sichuan. Structural insight into the mechanism of epothilone A bound to beta-tubulin and its mutants at Arg282Gln and Thr274Ile. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS[J]. 2012, 30(5): 559-573, https://www.webofscience.com/wos/woscc/full-record/WOS:000308104500006.
[83] 景园园, 郑仁慧, 李会学, 史强. Theoretical Study of the Electronic–Vibrational Coupling in the Qy States of the Photosynthetic Reaction Center in Purple Bacteria. J. PHYS. CHEM. B[J]. 2012, 1164-1171, http://ir.iccas.ac.cn/handle/121111/5508.
[84] 徐珍珍, 廖清, 史强, 姚建年, 付红兵. Low-Threshold Nanolasers Based on Slab-Nanocrystals of H-Aggregated Organic Semiconductors. ADV MATER[J]. 2012, 24(35): OP216-OP220, http://ir.iccas.ac.cn/handle/121111/28747.
[85] Li, Huixue, Zheng, Renhui, Shi, Qiang. Theoretical Study of Charge Carrier Transport in Organic Semiconductors of Tetrathiafulvalene Derivatives. JOURNAL OF PHYSICAL CHEMISTRY C[J]. 2012, 116(22): 11886-11894, https://www.webofscience.com/wos/woscc/full-record/WOS:000304888700006.
[86] Jing, Yuanyuan, Zheng, Renhui, Li, HuiXue, Shi, Qiang. Theoretical Study of the Electronic-Vibrational Coupling in the Q(y) States of the Photosynthetic Reaction Center in Purple Bacteria. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2012, 116(3): 1164-1171, http://dx.doi.org/10.1021/jp209575q.
[87] Xu, Sichuan, Chi, Shaoming, Jin, Yi, Shi, Qiang, Ge, Maofa, Wang, Shu, Zhang, Xingkang. Molecular dynamics simulation and density functional theory studies on the active pocket for the binding of paclitaxel to tubulin. JOURNAL OF MOLECULAR MODELING[J]. 2012, 18(1): 377-391, https://www.webofscience.com/wos/woscc/full-record/WOS:000298756500036.
[88] Xu, Zhenzhen, Liao, Qing, Shi, Qiang, Zhang, Haoli, Yao, Jiannian, Fu, Hongbing. Low-Threshold Nanolasers Based on Slab-Nanocrystals of H-Aggregated Organic Semiconductors. ADVANCED MATERIALS[J]. 2012, 24(35): OP216-OP220, https://www.webofscience.com/wos/woscc/full-record/WOS:000308399000005.
[89] 朱莉莉, 刘灏, 谢伟伟, 史强. Explicit system-bath correlation calculated using the hierarchical equations of motion method. J. CHEM. PHYS.[J]. 2012, 137(19): 194106,1-6, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000311458900008&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[90] 孙元元, 郑仁慧, 史强. Theoretical Study of Raman Spectra of Methanol in Aqueous Solutions: Non-Coincident Effect of the CO Stretch. J. PHYS. CHEM. B[J]. 2012, 4543-4551, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000302924800017&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[91] Yao, ChangJiang, Zheng, RenHui, Shi, Qiang, Zhong, YuWu, Yao, Jiannian. 1,4-Benzene-bridged covalent hybrid of triarylamine and cyclometalated ruthenium: a new type of organic-inorganic mixed-valent system. CHEMICAL COMMUNICATIONS[J]. 2012, 48(45): 5680-5682, http://dx.doi.org/10.1039/c2cc32471g.
[92] 郑仁慧, 孙元元, 史强. Theoretical study on resonance Raman scattering for C60 molecules in benzene solutions. VIB. SPECTROSC.[J]. 2012, 133-138, http://ir.iccas.ac.cn/handle/121111/5507.
[93] Sun, Yuanyuan, Zheng, Renhui, Shi, Qiang. Theoretical Study of Raman Spectra of Methanol in Aqueous Solutions: Non-Coincident Effect of the CO Stretch. JOURNAL OF PHYSICAL CHEMISTRY B[J]. 2012, 116(15): 4543-4551, http://dx.doi.org/10.1021/jp300178v.
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[95] 曹鑫强, 白书明, 吴义室, 廖清, 史强, 付红兵, 姚建年. Self-assembly of twisted tetrachloroperylenediimide chromophores into 2D brick-stone aggregates: exciton dynamics and photoconductivity. CHEM COMMUN[J]. 2012, 48(51): 6402-6405, http://ir.iccas.ac.cn/handle/121111/28751.
[96] Zhang, Chuang, Yan, Yongli, Jing, YuanYuan, Shi, Qiang, Zhao, Yong Sheng, Yao, Jiannian. One-Dimensional Organic Photonic Heterostructures: Rational Construction and Spatial Engineering of Excitonic Emission. ADVANCED MATERIALS[J]. 2012, 24(13): 1703-1708, https://www.webofscience.com/wos/woscc/full-record/WOS:000302014400005.
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[98] Zhu, Lili, Liu, Hao, Xie, Weiwei, Shi, Qiang. Explicit system-bath correlation calculated using the hierarchical equations of motion method. JOURNAL OF CHEMICAL PHYSICS[J]. 2012, 137(19): http://dx.doi.org/10.1063/1.4766358.
[99] 史强, 郑仁慧. Theoretical Study of Charge Carrier Transport in Organic Semiconductors of Tetrathiafulvalene Derivatives. J. PHYS. CHEM. C[J]. 2012, 11886-11894, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000304888700006&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[100] Cao, Xinqiang, Bai, Shuming, Wu, Yishi, Liao, Qing, Shi, Qiang, Fu, Hongbing, Yao, Jiannian. Self-assembly of twisted tetrachloroperylenediimide chromophores into two dimensional brick-stone aggregates: exciton dynamics and photoconductivity. CHEMICAL COMMUNICATIONS[J]. 2012, 48(51): 6402-6404, https://www.webofscience.com/wos/woscc/full-record/WOS:000304605700024.
[101] Zheng, Renhui, Wei, Wenmei, Sun, Yuanyuan, Shi, Qiang. Theoretical Study of Doubly Resonant IR-UV Hyper-Raman Scattering. JOURNAL OF PHYSICAL CHEMISTRY A[J]. 2011, 115(11): 2231-2237, https://www.webofscience.com/wos/woscc/full-record/WOS:000288400900018.
[102] Wang, Lei, Yang, WenWen, Zheng, RenHui, Shi, Qiang, Zhong, YuWu, Yao, Jiannian. Electronic Coupling between Two Cyclometalated Ruthenium Centers Bridged by 1,3,6,8-Tetrakis(1-butyl-1H-1,2,3-triazol-4-yl)pyrene. INORGANIC CHEMISTRY[J]. 2011, 50(15): 7074-7079, https://www.webofscience.com/wos/woscc/full-record/WOS:000293036000031.
[103] 韦文美, 郑仁慧, 景园园, 刘雅婷, 胡骏程, 叶勇, 史强. 过氧硝酸溶液拉曼谱的理论研究. 化学物理学报[J]. 2011, 24(5): 625-630, http://lib.cqvip.com/Qikan/Article/Detail?id=39812447.
[104] 郑仁慧, 景园园, 史强. Theoretical Study of Doubly Resonant IR-UV Hyper-Raman scattering. J. PHYS. CHEM. A.[J]. 2011, 115(11): 2231-2237, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000288400900018&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[105] 郑仁慧, 李会学, 史强. Theoretical investigation on sum-frequency vibrational spectroscopy off electronic resonance for limonene chiral liquids: the second-order Herzberg–Teller effect. CHEM. PHYS. LETT.[J]. 2011, 512(4): 269-272, http://ir.iccas.ac.cn/handle/121111/5503.
[106] Chen, Liping, Zheng, Renhui, Jing, Yuanyuan, Shi, Qiang. Simulation of the two-dimensional electronic spectra of the Fenna-Matthews-Olson complex using the hierarchical equations of motion method. JOURNAL OF CHEMICAL PHYSICS[J]. 2011, 134(19): https://www.webofscience.com/wos/woscc/full-record/WOS:000291109900039.
[107] 史强, 陈丽平, 朱莉莉. Quantum rate dynamics for proton transfer reaction in a model system: effect of the rate promoting vibrational mode. J. CHEM. PHYS.[J]. 2011, 135(4): 04450-1, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000293477300054&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[108] Wei, Wenmei, Zheng, Renhui, Jing, Yuanyuan, Liu, Yating, Hu, Juncheng, Ye, Yong, Shi, Qiang. Theoretical Study on Raman Spectra of Aqueous Peroxynitric Acid. CHINESE JOURNAL OF CHEMICAL PHYSICS[J]. 2011, 24(5): 625-630, https://www.webofscience.com/wos/woscc/full-record/WOS:000297139200018.
[109] Xu, Sichuan, Chi, Shaoming, Jin, Yi, Shi, Qiang, Ge, Maofa, Wang, Shu, Zhang, Xingkang. The key residues of active sites located on beta-tubulin forming an active pocket for paclitaxel binding. AMINO ACIDS[J]. 2011, 41: S36-S36, https://www.webofscience.com/wos/woscc/full-record/WOS:000306273000111.
[110] 吴晓楠, 丁迅雷, 白书明, 徐波, 何圣贵, 史强. Experimental and Theoretical Study of the Reactions between Cerium Oxide Cluster Anions and Carbon Monoxide: Size-Dependent Reactivity of CenO2n+1-(n=1-21). J. PHYS. CHEM. C[J]. 2011, 115(27): 13329-13337, http://ir.iccas.ac.cn/handle/121111/5499.
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[112] 李会学, 郑仁慧, 史强. Theoretical study on charge carrier mobilities of Tetrathiafulvalene derivatives. PHYS. CHEM. CHEM. PHYS.[J]. 2011, 13: 5642-5650, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000288447100020&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[113] 朱莉莉, 南广军, 史强. 反转区电子转移速率的理论研究. 中国科学：化学[J]. 2011, 41(8): 1421-1428, http://lib.cqvip.com/Qikan/Article/Detail?id=38801572.
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[115] 郑仁慧, 孙元元, 史强. Theoretical study of the Infrared and Raman line shapes of liquid Methanol. PHYS. CHEM. CHEM. PHYS.[J]. 2011, 13(6): 2027-2035, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000286628200011&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[116] 郑仁慧, 景园园, 史强. Theoretical Study On Raman Spectra of Aqueous Peroxynitric Acid. CHIN. J. CHEM. PHYS.[J]. 2011, 133(6): 1895-1901, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000297139200018&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[117] Shi, Qiang, Zhu, Lili, Chen, Liping. Quantum rate dynamics for proton transfer reaction in a model system: Effect of the rate promoting vibrational mode. JOURNAL OF CHEMICAL PHYSICS[J]. 2011, 135(4): https://www.webofscience.com/wos/woscc/full-record/WOS:000293477300054.
[118] 史强, 陈丽平. Mixed quantum-classical simulations of charge transport in organic materials: numerical benchmark of the Su-Schrieffer-Heeger model. J. CHEM. PHYS[J]. 2011, 134(24): 244116-244116, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000292331900019&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[119] 南广军, 史强. Influences of molecular packing on the charge mobility of organic semiconductors: From quantum charge transfer rate theory beyond the first-order perturbation. PHYS. CHEM. CHEM. PHYS[J]. 2011, 13(20): 9736-9746, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000290224900078&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
[120] 陈丽平, 郑仁慧, 景园园, 史强. Simulation of the two-dimensional electronic spectra of the Fenna-Matthews-Olson complex using the hierarchical equations of motion method. J. CHEM. PHYS[J]. 2011, 134(19): 194508-194508, http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000291109900039&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=3a85505900f77cc629623c3f2907beab.
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[123] Zheng, Renhui, Jing, Yuanyuan, Chen, Liping, Shi, Qiang. Theory of proton coupled electron transfer reactions: Assessing the Born-Oppenheimer approximation for the proton motion using an analytically solvable model. CHEMICAL PHYSICS[J]. 2011, 379(1-3): 39-45, http://dx.doi.org/10.1016/j.chemphys.2010.11.001.
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[125] Kang, Longtian, Fu, Hongbing, Cao, Xinqiang, Shi, Qiang, Yao, Jiannian. Controlled Morphogenesis of Organic Polyhedral Nanocrystals from Cubes, Cubooctahedrons, to Octahedrons by Manipulating the Growth Kinetics. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY[J]. 2011, 133(6): 1895-1901, https://www.webofscience.com/wos/woscc/full-record/WOS:000287831800062.
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[127] Wu, XiaoNan, Ding, XunLei, Bai, ShuMing, Xu, Bo, He, ShengGui, Shi, Qiang. Experimental and Theoretical Study of the Reactions between Cerium Oxide Cluster Anions and Carbon Monoxide: Size-Dependent Reactivity of CenO2n+1- (n=1-21). JOURNAL OF PHYSICAL CHEMISTRY C[J]. 2011, 115(27): 13329-13337, http://dx.doi.org/10.1021/jp202077s.
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[136] Yuan Bo, Xu Zeren, Xie Zhuojun, Shi Qiang, Zhang Xingkang, Xu Sichuan. X-Ray Fluorescence Spectrum Analysis of Chemical Element for Spider and Silkworm Silk and Its Applications. SPECTROSCOPY AND SPECTRAL ANALYSIS[J]. 2010, 30(7): 1983-1989, http://www.irgrid.ac.cn/handle/1471x/897779.
[137] Wang, Linjun, Li, Qikai, Shuai, Zhigang, Chen, Liping, Shi, Qiang. Multiscale study of charge mobility of organic semiconductor with dynamic disorders. PHYSICAL CHEMISTRY CHEMICAL PHYSICS[J]. 2010, 12(13): 3309-3314, http://dx.doi.org/10.1039/b913183c.
[138] Nan GuangJun, Zheng RenHui, Shi Qiang, Shuai ZhiGang. Mixed Quantum-Classical Approaches to Calculating Charge Transfer Rate Constants: Applications to Realistic Systems. ACTA PHYSICO-CHIMICA SINICA[J]. 2010, 26(7): 1755-1760, http://www.irgrid.ac.cn/handle/1471x/897778.
[139] Shi, Qiang, Geva, Eitan. A self-consistent treatment of electron transfer in the limit of strong friction via the mixed quantum classical Liouville method. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 131(3): https://www.webofscience.com/wos/woscc/full-record/WOS:000268206800045.
[140] Wu, Yishi, Li, Yuliang, Li, Huixue, Shi, Qiang, Fu, Hongbing, Yao, Jiannian. N-type cascade electron transfer along an oxidative gradient. CHEMICAL COMMUNICATIONS[J]. 2009, 6955-6957, https://www.webofscience.com/wos/woscc/full-record/WOS:000271647200015.
[141] Nan, Guangjun, Shi, Qiang, Shuai, Zhigang. Nonperturbative time-convolutionless quantum master equation from the path integral approach. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 130(13): https://www.webofscience.com/wos/woscc/full-record/WOS:000265053200007.
[142] Xu, RuiXue, Tian, BaoLing, Xu, Jian, Shi, Qiang, Yan, YiJing. Hierarchical quantum master equation with semiclassical Drude dissipation. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 131(21): http://dx.doi.org/10.1063/1.3268922.
[143] Chen, Liping, Shi, Qiang. Quantum rate dynamics for proton transfer reactions in condensed phase: The exact hierarchical equations of motion approach. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 130(13): https://www.webofscience.com/wos/woscc/full-record/WOS:000265053200040.
[144] Shi, Qiang, Chen, Liping, Nan, Guangjun, Xu, RuiXue, Yan, YiJing. Efficient hierarchical Liouville space propagator to quantum dissipative dynamics. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 130(8): [145] Shi, Qiang, Chen, Liping, Nan, Guangjun, Xu, Ruixue, Yan, YiJing. Electron transfer dynamics: Zusman equation versus exact theory. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 130(16): [146] Zheng, Renhui, Wei, Wenmei, Shi, Qiang. Density Functional Theory Study on Sum-Frequency Vibrational Spectroscopy of Arabinose Chiral Solutions. JOURNAL OF PHYSICAL CHEMISTRY A[J]. 2009, 113(1): 157-164, http://dx.doi.org/10.1021/jp808228e.
[147] Chen, Liping, Zheng, Renhui, Shi, Qiang, Yan, YiJing. Optical line shapes of molecular aggregates: Hierarchical equations of motion method. JOURNAL OF CHEMICAL PHYSICS[J]. 2009, 131(9): https://www.webofscience.com/wos/woscc/full-record/WOS:000269625400015.
[148] Mcrobbie, Porscha L, Hanna, Gabriel, Shi, Qiang, Geva, Eitan. Signatures of Nonequilibrium Solvation Dynamics on Multidimensional Spectra. ACCOUNTS OF CHEMICAL RESEARCH[J]. 2009, 42(9): 1299-1309, https://www.webofscience.com/wos/woscc/full-record/WOS:000269861400011.
[149] Ma, YanPing, He, ShengGui, Ding, XunLei, Wang, ZheChen, Xue, Wei, Shi, Qiang. Theoretical study of intermolecular interactions in meso-tetraphenylporphyrin diacid dimer (H4TPPCl2)(2). PHYSICAL CHEMISTRY CHEMICAL PHYSICS[J]. 2009, 11(14): 2543-2552, http://www.corc.org.cn/handle/1471x/2398508.
[150] Shi, Qiang, Geva, Eitan. A comparison between different semiclassical approximations for optical response functions in nonpolar liquid solution. II. The signature of excited state dynamics on two-dimensional spectra. JOURNAL OF CHEMICAL PHYSICS[J]. 2008, 129(12): https://www.webofscience.com/wos/woscc/full-record/WOS:000259884600042.

景园园  硕士研究生  070304-物理化学  80032-化学研究所

李会学  博士研究生  070304-物理化学  80032-化学研究所