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Xun Sun; Yue Qiu; Bo Jiang; Zhaoyu Chen; Chenghao Zhao; Hao Zhou; Li Yang; Lishuang Fan; Yu Zhang; Naiqing Zhang*, Isolated Fe-Co heteronuclear diatomic sites as efficient bifunctional catalysts for high-performance lithium-sulfur batteries, Nature Communications, 2023, 14(1)（IF: 17.694，一区）
Dongcun Xu, Gang Fu, Zhongming Li, Wenqing Zhen, Hongyi Wang, Meiling Liu, Jianmin Sun*, Jiaxu Zhang*, and Li Yang*, Functional regulation of ZnAl-LDHs and mechanism of photocatalytic reduction of CO2: A DFT study, Molecules, 2023, 28, 738. （IF: 4.906，二区）
Zhao, S.; Fu, G.; Zhen, W.; Yang, L.*; Sun, J.*; Zhang, J.* Reaction mechanism conversion induced by the contest of nucleophile and leaving group. Phys. Chem. Chem. Phys. 2022, 24 (39), 24146-24154.（IF=3.945）
Wang, X.; Yang, L.*; Fu, G.; Chen, Y.; Yang, C.; Sun, J.* Experimental and theoretical investigation for the cycloaddition of carbon dioxide to epoxides catalyzed by potassium and boron co-doped carbon nitride. J. colloid. Interf. Sci., 2022, 609, 523-534.（IF: 9.965，一区）
Sun, X ; Tian, D; Song, XQ; Jiang, B; Zhao, CH; Zhang, Y; Yang, L; Fan, LSN ; Yin, XJ; Zhang, NQ*, In situ conversion to construct fast ion transport and high catalytic cathode for high-sulfur loading with lean electrolyte lithium-sulfur battery, Nano Energy, 2022, 95, 106979.（IF: 16.602，一区）
Wang, X.; Huang, Y.; Lin, Y.; Chen, H.; Li, J.; Zhao, C.; Liu, X.*; Yang, L.; Huang, X.* Life-Inspired Endogenous Dynamic Behavior of Lipid Droplet-like Microcompartments in Artificial Adipocyte-like Structures. CCS Chem. 2021, 3 (11), 2782-2794. （IF=0.000）
Yujie Wang, Siwei Zhao, Xu Liu, Wenqing Zhen, Gang Fu, and Li Yang,* Saozeng Sun, Jiaxu Zhang,* Direct Dynamics in a Proton Transfer Reaction of Isomer Product Competition. Insight into the Suppressed Formation of Isoformyl, Phys. Chem. Chem. Phys. 2021, 23, 10814. （IF: 3.676，二区）
Siwei Zhao, Su Yan, Xu Liu, Li Yang,* Shaozeng Sun, and Jiaxu Zhang*, Effect of Water on Dynamics of HOCO Radical, Chem. Physics. 2021, 546, 111173.
Xu Liu, Sitong Yin, Siwei Zhao, Li Yang, Shaozeng Sun and Jiaxu Zhang, Theoretical studies on CH4 combustion in O2/H2O atmosphere, Comput. Theor. Chem. 2021, 1199, 113199.
Haixue Cheng, Siwei Zhao, Meng Gu, Xu Liu, Jiaxu Zhang*, Shaozeng Sun, Li Yang*, Direct dynamics simulations on the atomic mechanisms of 4O+ + CH3I reaction. Int. J. Mass Spectrom. 2021, 461, 116504.
Jinnan Cui, Siwei Zhao, Xu Liu, Li Yang*, Shaozeng Sun, Jiaxu Zhang*, Theoretical studies on NH2 + NO2 reaction: Driven by reaction dynamics. Int. J. Mass Spectrom. 2021, 462, 116522.
Xin Wang,Lei Shi,YangLin Chen,Chaokun Yang,Li Yang, Jianmin Sun*. Facile synthesis of carboxyl- and hydroxyl functional carbon nitride catalyst for efficient CO2 cycloaddition. Molec.Catal.2021,515, 111924（IF: 5.062，二区）
Meng Gu, Meng Gu , Ruihan Guo, Jiaxu Zhang？ , Yuan Yao？ , Li Yang*, Thermal dissociation of the singly protonated Arginine: Competition between side-chain and backbone fragmentation, Chem. Phys., 2020, (538), 110890.
Martin Somer, A.; Macaluso, V.; Barnes, G. L.; Yang, L.; Pratihar, S.; Song, K.; Hase, W. L.*; Spezia, R.* Role of Chemical Dynamics Simulations in Mass Spectrometry Studies of Collision-Induced Dissociation and Collisions of Biological Ions with Organic Surfaces., J. Am. Soc. Mass Spectrom. 2020, 31, 2-24. （IF: 3.676，二区）
Chaokun Yang, Yanglin Chen, Ping Xu, Li Yang, Jiaxu Zhang,* and Jianmin Sun*, Facile synthesis of zinc halide-based ionic liquid for efficient conversion of carbon dioxide to cyclic carbonates, Molecular Catalysis 2020, 480, 110637. （IF: 5.062，二区）
Gu, M.; Zhang, J.*; Hase, W. L.; Yang, L.* Direct Dynamics Simulations of the Thermal Fragmentation of a Protonated Peptide Containing Arginine. Acs Omega 2020, 5, 1463-1471.
Chao Liu, Li Yang, Jiaxu Zhang, Jianmin Sun*, Facile fabrication of a heterogeneous Co-modified pyridinecarboxaldehyde-polyethylenimine catalyst for efficient CO2 conversion under mild conditions. Inorg. Chem. Front. 2020, 7, 1140-1147. （IF: 6.569，二区）
Xin Wang, Li Yang*, Yanglin Chen, Chaokun Yang, Jianwen Lan, and Jianmin Sun*, Metal-Free Triazine-Incorporated Organosilica Framework Catalyst for the Cycloaddition of CO2 to Epoxide under Solvent-Free Conditions. Ind. Eng. Chem. Res. 2020, 59, 48, 21018–21027.
Ning, H.; Huang, X.; Yang, L.*; Zhang, J.* Molecular Design of Organoplatinum(II) Complexes Through a DFT/TDDFT Study: Photophysical Properties and Intermolecular Interactions. Comput. Theor. Chem. 2019, 1150, 91-101.
Gu, M.; Yang, L.*; Hase, W. L.; Sun, J.*; Zhang, J.* Energy Transfer of Peptide Ions Colliding with a Self-Assembled Monolayer Surface. The Influence of Peptide Ion Size. Chinese J. Chem. 2019, 37, 237-243.（IF: 6.000，二区）
Gu, M.; Liu, X.; Yang, L.*; Sun, S.*; Zhang, J.* Dynamics of Cl-(H2O) + CH3I Substitution Reaction: The Influences of Solvent and Nucleophile. J. Phys. Chem. A 2019, 123, 2203-2210.
Alyson Shoji, David Schanzenbach, Ron Merrill, Jiaxu Zhang, Li Yang, and Rui Sun*, Theoretical Study of the Potential Energy Profile of the HBr+ + CO2 → HOCO+ + Br· Reaction, J. Phys. Chem. A 2019, 123, 9791？9799.
Xu Liu, Jiaxu Zhang*, Li Yang*, Jianmin Sun*, Competition of F/OH-induced SN2 and proton-transfer reactions with increased solvation, J. Phys. Chem. A 2018, 122 (), 9446-9453. (封面).
Xu Liu, Jiaxu Zhang*, Li Yang*, William L. Hase*, How a Solvent Molecule Affects Competing Elimination and Substitution Dynamics. Insight into Mechanism Evolution with Increased Solvation, J. Am. Chem. Soc. 2018, 140 (35), pp 10995–11005. （IF: 15.419，一区）
Jianfei Wang, Hongyan Ning, Jiaxu Zhang*, Li Yang*, Influences of enhanced conjugated framework on the structures and photophysical properties of BF2 core compounds containing 1,8-naphthyridine derivative: A DFT/TD-DFT study, Optical Materials, 2018, 84, 694–702.
Xin Wang,Mengshuai Liu, Li Yang,* Jianwen Lan, Yanglin Chen, and Jianmin Sun*, Synthesis of Zn Modified Carbon Nitrides Heterogeneous Catalyst for the Cycloaddition of CO2 to Epoxides, ChemistrySelect 2018, 3, 4101 – 4109.
Wang, M. Q.; Wang, B. N.; Li, W. Q.; Zhou, X.; Yang, L*.; Tian, W. Q. Electronic and Spectroscopic Properties of La-2@C-112 Isomers. Chem. Res. Chinese U. 2018, 34, 241-246.
Xu Liu, Chenyang Zhao, Li Yang,* Jiaxu Zhang* & Rui Sun, "Indirect dynamics in SN2@N. Insight into the influence of central atom" Phys. Chem. Chem. Phys 2017, 19，22691-22699. （IF: 3.676，二区）
Yong-Tao Ma, Xinyou Ma, Anyang Li, Hua Guo, Li Yang, Jiaxu Zhang and William L. Hase* "Potential energy surface stationary points and dynamics of the F_ + CH3I double inversion mechanism", Phys. Chem. Chem. Phys 2017, 20127-20136.（IF: 3.676，二区）
Linyao Zhang, Li Yang, Yijun Zhao, Jiaxu Zhang, Dongdong Feng, and Shaozeng Sun "Effects of Water Molecule on CO Oxidation by OH: Reaction Pathways, Kinetic Barriers, and Rate Constants", J. Phys. Chem. A 2017, 121(26), 4868-4880.
Eduardo Carrascosa, Jennifer Meyer, Jia-xu Zhang, Martin Stei, Tim Michaelsen, William L. Hase, Li Yang, and Roland Wester “Imaging dynamic fingerprints of competing E2 and SN2 reactions” Nature Communication, 2017, 8, 25.（IF: 14.919，一区）
Xu Liu, Jing Xie, Jia-xu Zhang*, Li Yang*, and William L. Hase “Steric Effects of Solvent Molecules on SN2 Substitution Dynamics” J. Phys. Chem. Lett. 2017, 8 (8), 1885.（IF: 9.353，一区）
Li Yang, Xu Liu, Jia-xu Zhang* and Jing Xie “Effects of Microsolvation on a SN2 Reaction: Indirect Atomistic Dynamics and Weakened Suppression of Reactivity” Phys. Chem. Chem. Phys 2017, 19, 9992.（IF: 3.676，二区）
Li Yang, Jia-xu Zhang*, Jing Xie, Xinyou Ma, Linyao Zhang, Chenyang Zhao, and William L. Hase “Competing E2 and SN2 Mechanisms for the F？ + CH3CH2I Reaction” J. Phys. Chem. A 2017, 121, 1078.
Li Yang and Jiaxu Zhang,* "The Non-IRC Mechanism of OH Anion Reaction with CH3OOH Revealed by Direct Dynamics Simulations" Comput. Theor. Chem., 2016, 1090, 47-51.
Jiaxu Zhang, Li Yang,* and Li Sheng “Electronic Structure Theory Study of the Microsolvated F–(H2O) + CH3I SN2 Reaction” J. Phys. Chem. A 2016, 120, 3613-3622.
Xu Liu, Jiaxu Zhang*, Li Yang,* and Rui Sun "Theoretical Studies on F– + NH2Cl Reaction: Nucleophilic Substitution at Neutral Nitrogen" J. Phys. Chem. A 2016, 120,3740-3746.
Li Yang and Jiaxu Zhang,* "The potential energy surface of OH anion reaction with CH3OOH: Theoretical investigations" Comput. Theor. Chem., 2016, 1089, 1-5.
Jiaxu Zhang, Li Yang,* Jing Xie, and William L. Hase “Microsolvated F-(H2O) + CH3I SN2 Reaction Dynamics. An Insight into the Suppressed Formation of Solvated Products” J. Phys. Chem. Lett. 2016, 7 (4), 660.（IF: 9.353，一区）
Hu, Y. Y.; Li, W. Q.; Yang, L.; Feng, J. K.; Tian, W. Q.* The electronic properties and nonlinear optical responses of the intermediate structures in rolling graphene to carbon nanotubes. Canadian Journal Of Chemistry 2016, 94, 50-59.
Hu, Y. Y.; Li, W. Q.*; Yang, L.; Feng, J. K.; Tian, W. Q.* Electronic properties and nonlinear optical responses of boron/nitrogen-doped zigzag graphene nanoribbons. Canadian Journal Of Chemistry 2016, 94, 620-625.
Yuxin Li, Xiujie Hu,* Shuyun Zhou,* Li Yang, Jun Yan, Chenghua Sun, and Ping Chen “A facile process to produce highly conductive poly(3,4-ethylenedioxythiophene) films for ITO-free flexible OLED devices” J. Mater. Chem. C, 2014, 2, 916-924.（IF: 7.393，一区）
Li Yang, Daniel Tunega, Lai Xu, Niranjan Govind, Rui Sun, Ramona Taylor, Hans Lischka, Wibe A. DeJong, and William L. Hase “Comparison of Cluster, Slab, and Analytic Potential Models for the Dimethyl Methylphosphonate (DMMP)/TiO2 (110) Intermolecular Interaction” J. Phys. Chem. C 2013, 117 (5), 17613-17622.（IF: 4.126，二区）
Chen Li, Li Yang*, Meng, Xiujie Hu, Zhixiang Wei, Ping Chen, and Shuyun Zhou* “Tuning PANI Nanostructure by Driving Force for Diverse Capacitance Performance” RSC Advances 2013, 3, 21315-21319.
S. Pratihar, S. Kohale, L. Yang, P. Manikandan, K. Gibson, D. Killelea, H. Yuan, S. Siberner, and W. L. Hase “Chemical Dynamics Simulations of High energy Xenon atom Collisions with the {0001} Surface of Hexagonal Ice” J. Phys. Chem. C 2013, 117 (5), 2183-2193. （IF: 4.126，二区）
解晓艳，庞玉莲，肖时卓，杨丽，邹应全*，陈萍，周树云* “磺酸肟酯类光产酸剂的制备及性能研究”影响科学与光化学，2013， 31(4), 305-315.
Jia-xu Zhang, Li Yang, and Diego Troya,* “Chemical Dynamics Simulations of Hydroxyl Radical Reaction with Ethene”, Chin. J. Chem. Phys. 2013, Vol. 6, 765-773.
Li Yang and William L. Hase “Direct Dynamics Determination of the Reaction Pathways for Decomposition of the Cross-Linked Epoxy Resin Constituent CH3-NH-CH=CH-CH3” Computational and Theoretical Chemistry, 2012, 990, 62-66.
Li Yang and William L. Hase “Use of direct dynamics simulations to determine unimolecular reaction paths and Arrhenius parameters for large molecules” J. Chem. Theory Comput. 2011, 7, 3478-3483 (11月份封面)
Li Yang and William L. Hase “A Model DMMP/TiO2(s) Intermolecular Potential Energy Function Developed From AB INITIO Calculations” J. Phys. Chem. C 2011, 115, 12403-12423 （IF: 4.126，二区）
G. L. Barnes, K. Young, L. Yang, and W. L. Hase “Fragmentation and Reactivity in Collisions of Protonated Diglycine with Chemical Modified F-SAM Surfaces” J. Chem. Phys. 2011, 134, 094106（IF: 3.488，二区）
Li Yang, Robert M. Shroll, J. Zhang, U. Lourderaj, Jiangping Wang, M. T. Rodgers, Emilio Martínez-Nú？ez, Srirangam V. Addepalli and William L. Hase “Theoretical Investigation on the Mechanism of Gas-Phase Unimolecular Decomposition of DMMP” J. Phys. Chem. A 2009, 113, 13762-13771
Li Yang, Oleg A. Mazyar, U. Lourderaj, and William L. Hase “Chemical Dynamics Simulations of Energy Transfer in Collisions of Protonated Peptide Ions with a Perfluorinated Alkylthiol Self-Assembled Monolayer Surface” J. Phys. Chem. C 2008, 112, 9377-9386 （IF: 4.126，二区）
Li Yang, Ai-Min Ren, Ji-Kang Feng, Xiao-Dong Liu, Yu-Guang Ma, and Hong-Xing Zhang “Theoretical Studies of Ground and Excited Electronic States in a Series of Rhenium(I) Bipyridine Complexes Containing Diarylethynyl-Based Structure” Inorganic Chemistry, 2004, 43, 5961-5972 （IF: 5.165，二区）
Li Yang, Ai-Min Ren, Ji-Kang Feng, Xiao-Juan Liu, Yu-Guang Ma, Ming Zhang, Xiao-Dong Liu, Jia-Cong Shen, and Hong-Xing Zhang “Theoretical Studies of Ground and Excited Electronic States in a Series of Halide Rhenium(I) Bipyridine Complexes” J. Phys. Chem. A, 2004, 108, 6797-6808
Li Yang, Ai-Min Ren, Ji-Kang Feng, and Ji-Fen Wang “Theoretical Investigation of Optical and Electronic Property Modulations of π-Conjugated Polymers Based on the Electron-Rich 3,6-Dimethoxy-fluorene Unit” J. Org. Chem. 2005, 70, 3009-3020 （IF: 4.354，二区）
Li Yang, Ji-Kang Feng, and Ai-Min Ren “Theoretical Study on Electronic Structure and Optical Properties of Phenothiazine-Containing Conjugated Oligomers and Polymers” J. Org. Chem., 2005, 70, 5987-5996
Li Yang, Ji-Kang Feng, and Ai-Min Ren “Theoretical Studies on the Electronic and Optical Properties of Two New Alternating Fluorene/Carbazole Copolymers” J. Comput. Chem., 2005, 26, 969–979
Li Yang, Ji-Kang Feng, Ai-Min Ren, Ming Zhang, Yu-Guang Ma, and Liao-Dong Liu “Structures, Electronic States and Electroluminescent Properties of a Series of CuI Complexes” Eur. J. Inorg. Chem. 2005, 1867–1879
Li Yang, Ji-Kang Feng, Yi Liao, Ai-Min Ren “A theoretical investigation on the electronic and optical properties of p-conjugated copolymers with an efficient electron-accepting unit bithieno[3,2-b:2030-e]pyridine” Polymer 2005, 46, 9955-9964
Li Yang, Ji-Kang Feng, Ai-Min Ren “Theoretical Studies on the Electronic and Optical Properties of Two Thiophene-Fluorene Based π-Conjugated Copolymers” Polymer 2005, 46, 10970-10981
Li Yang, Yi Liao, Ji-Kang Feng, and Ai-Min Ren “Theoretical Studies of the Modulation of Polymer Electronic and Optical Properties through the Introduction of the Electron-Donating 3,4-Ethylenedioxythiophene or Electron-Accepting Pyridine and 1,3,4-Oxadiazole Moieties” J. Phys. Chem. A 2005, 109, 7764-7774
Li Yang, Ai-Min Ren, Ji-Kang Feng “Theoretical Studies of Ground and Excited Electronic States of Complexes M(CO)4(phen) (M = Cr, Mo, W; phen=1,10-phenanthroline)” Synthetic Metals 2005, 152, 265-268
Li Yang, Ji-Kang Feng, Ai-Min Ren, Chia-Chung, Sun “The electronic structure and optical properties of carbazole-based conjugated oligomers and polymers: A theoretical investigation” Polymer, 2006, 47(4), 1397-1404
Li Yang, Ji-Kang Feng, Ai-Min Ren, Chia-Chung Sun “Theoretical investigations on the modulation of the polymer electronic and optical properties by introduction of phenoxazine” Polymer, 2006, 47 (9), 3229-3239
Li Yang, Ji-Kang Feng, Ai-Min Ren “Structural, Electronic and Optical Properties of A Series of Oligofluorene-Thiophene Oligomers and Polymers” Journal of Molecular Structrue: THEOCHEM 2006, 758, 29-39
Li Yang, Ji-Kang Feng, Ai-Min Ren “Theoretical Investigations of the Substituent Effect on the Absorption and Emission Properties for a Series of Platinum (II) Complexes Supported by Tetradentate N2O2 Chelates” Journal of Molecular Structrue: THEOCHEM 2006, 760, 193-201
Li Yang, Ji-Kang Feng, Wai-Yeung Wong, Suk-Yue Poon “Electronic structure and optical properties of germanium-bridged platinum(II)-containing diethynylfluorene monomer and oligomers: A theoretical investigation” Polymer, 2007, 48(21), 6457-6463
Li Yang, Ji-Kang Feng, Yi Liao, Ai-Min Ren “Theoretical studies on the electronic and optical properties of two blue-emitting fluorene-pyridine-based copolymers” Optical Materials 2007, 29, 642
Li Yang, Ji-Kang Feng, Ai-Min Ren “Theoretical study on electronic structure and optical properties of novel donor-acceptor conjugated copolymers derived from benzothiadiazole and benzoselenadiazole” Journal of Molecular Structrue: THEOCHEM, 2007, 8016(1-3), 161-170
Li Yang, Ji-Kang Feng, Ai-Min Ren "Electronic properties of two series of blue-emitting conjugated oligomers and polymers based on cyanostilbene: A quantum chemistry study” Chinese Journal Of Chemsitry, 2007, 25(10), 1491-1498
Li Yang, Ji-Kang Feng, Ai-Min Ren “Theoretical studies on several TPA materials with three different pi electron centers” Chemical Journal Of Chinese Universities-Chinese 2004, 25 (3), 526-530
Liu XD, Ren AM, Feng JK, Li Yang, Yang B, Sun CC “Theoretical studies of electronic structures, electronic spectra and substituent effect in cyclometalated phenylpyridine Ir (III) complex and its derivatives using density functional theory” Chemical Journal Of Chinese Universities-Chinese 2004, 25 (12), 2295-2298
Yi Liao, Ji-Kang Feng, Li Yang, Ai-Min Ren, and Hong-Xing Zhang “Theoretical Study on the Electronic Structure and Optical Properties of Mercury-Containing Diethynylfluorene Monomer, Oligomer, and Polymer” Organometallics 2005, 24, 385-394 （IF: 3.876，二区）
Li M, Zhang M, Zeng M, Zhang W, Yang B, Ma YG, Li YZ, Li Yang, Feng JK “Electrochemical properties and electronic energy level of phosphorescent complexes (L)Re(CO)(3)Cl(L = alpha,alpha-diamine)” Chemical Journal Of Chinese Universities-Chinese 2005, 26 (2), 317-320
Zhang M, Lu P, Wang XM, Xia H, Zhang W, Yang B, Liu LL, Li Yang, Yang M, Ma YG, Feng JK, Wang DJ “Synthesis, characterization and photophysical properties of rhenium(I)-containing polyfluorene-based copolymers” Thin Solid Films 2005, 477 (1-2), 193-197
Wang J. F., Feng J.K., Ren A.M., Li Yang, “Theoretical studies of the structure, absorption and emission properties of terfluorene and ter(9,9-diarylfluorene) derivatives” Chinese Journal Of Chemsitry, 2005, 23 (12), 1618-1624
Liao, Yi, Shi, Li-Li, Feng, Ji-Kang, Li Yang, Ren, Ai-Min “Effect of substitution on the structures and optoelectronic properties of mercury-containing diethynylfluorene” Journal of Theoretical & Computational Chemistry 2006, 5, 401-409
Liu, X. D., Feng, J. K., Ren, A. M., Li Yang, Yang, Bing, Ma, Yuguang “Theoretical studies of electronic structures, absorption and emission spectra in cyclometalated phenylpyridine Ir(III) complex and its derivatives using density functional theory” Optical Materials, 2006, 29(2-3), 231-238
Liu, X. D., Ren, A. M., Feng, J. K., Li Yang, Xu Hai, Shi Min-Min, Sun Chia-Chung “Quantum chemical investigation for electronic structure and spectrum of F-substituted Alq(3) derivatives: An approach to blue luminescence of Alq(3) derivatives” Chemical Journal Of Chinese Universities-Chinese, 2006, 27(11), 2156-2159
Liao, Yi, Yang, Guo-Chun, Feng, Ji-Kang, Shi, Li-Li, Yang, Shuang-Yang, Li Yang, Ren, Ai-Min “Theoretical study on the optoelectronic properties of electron-withdrawing substituted diethynylfluorenyl gold(I) complexes” J. Phys. Chem. A, 2006, 110(48), 13036-13044
Liao Yi, Shi L. L., Feng J. K., Li Yang, Ren Ai-min “Luminescent properties of mercury-taining diethynylfluorene derivatives” Chemical Research In Chinese Universities, 2007, 23 (1), 92-95
Liu B., Feng J.K., Ren A.M., Li Yang, Zou Lu-Yi “Theoretical investigation on electronic structure and optical properties of polyfluorene by copolymerization with dibenzothiophene” Acta Chimica Sinica 2007, 65(8), 673-677
Bo D.-S., Ren A.M., Feng J.K., Li Yang, “Theoretical studies on the ground state and excited state of poly (3,9-carbazole)” Chemical Journal Of Chinese Universities-Chinese, 2007, 28(5), 955-959
Li, Y. Y., Ren, A.M., Feng, J. K., Li Yang, Sun, Chia-Chung “A theoretical investigation on the absorption and emission properties of isomeric benzofuran trimers” Optical Materials, 2007, 29(12), 1571-1578
Li Yan, Feng J.K., Ren A.M., Li Yang “Theoretical investigation of electronic structures and optical properties of conjugated polymers derived from fluorene and benzoselenadiazole” Chemical Journal Of Chinese Universities-Chinese, 2007, 28(8), 1561-1565
Li Y. Y., Ren A. M., Feng J. K., Li Yang, “Theoretical investigation on the luminescent properties of PTB/PBI copolymer” Acta Chimica Sinica 2008, 66(10), 1196-1202
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