[31] Dong Zheng#, Wenxi Li#, Junchuan Liang#, Xueping Wang, Maokai Yu, Huaizhu Wang, Xiuxiu Wang*, Jing Zhao*, Zhong Jin*, Jing Ma*, Study of Azobenzene-modified Black Phosphorus for Potential Tumor Therapy. ACS Appl. Mater. Interfaces, 2024, 10.1021/acsami.4c13397.

[30] Ling-Ao Gui#, Jiawei Chen#, Yi-Fan Zhang, Long-He Li, Jian-Rong Li, Zhao-Bo Hu*, Shi-Yong Zhang, Jinlei Zhang, Zhenyi Zhang, Heng-Yun Ye, Yan Peng*, Jing Ma*, You Song*, Room-temperature magnetocapacitance spanning 97 K hysteresis in molecular material. Angew. Chem. Int. Ed., 2024, e202416380.

[29] Qiao Yuan#, Yating Gu#, Weimiao Chen, Yue Zhang, Xiangen Song*, Yangming Ding, Xingju Li, Lei Zhu, Zheng Jiang, Li Yan, Jing Ma*, Yunjie Ding*, Heterogeneous Carbonylation of Alcohols on Charge-Density-Distinct Mo−Ni Dual Sites Localized at Edge Sulfur Vacancies. Angew. Chem. Int. Ed., 2024, e202411632.

[28] Xinmei Song, Yang Ge, Xiaolan Xue, Xingkai Ma, Qianchuan Yu, Mengfei Zhu, Yaoda Wang, Junchuan Liang, Zuoxiu Tie, Jing Ma*, Zhong Jin*, Electrolyte-triggered in-situ polymerization of multi-site organic cathodes for superior-longevity cation-anion co-storage secondary batteries. Chem. Eng. J., 2024, 499, 156359.

[27] Wei Liu#, Qiang Zhu#, Chao-Nan Yang#, Ying-Huan Fu, Ji-Chang Zhang, Meng-Yin Li, Zhong-Lin Yang, Kai-Li Xin, Jing Ma, Mathias Winterhalter, Yi-Lun Ying*, Yi-Tao Long, Single-molecule sensing inside stereo- and regio-defined hetero-nanopores. Nat. Nanotech., 2024, 19, 1693-1701.

[26] Fangyan Li#, Yiding Jiao#, Shuo Yang#, Wei Mao#, Qiantu Tao#, Chenyu Bai, Er He, Luhe Li, Tingting Ye, Yiran Li, Jiacheng Wang, Junye Ren, Yuanzhen Wang, Rui Gao, Qianming Li, Jiang Lu, Jie Song, Jing Ma, Yu Deng, Peng Wang, Ye Zhang*, Electrochemical Activation Inducing Rocksalt-to-Spinel Transformation for Prolonged Service Life of LiMn2O4 Cathodes. Small, 2024, 2406116.

[25] Miao Wang#, Shufan Li#, Yuming Gu#, Wenjie Xu, Huaizhu Wang, Jingjie Sun, Shuangming Chen, Zuoxiu Tie, Jing-Lin Zuo, Jing Ma*, Jian Su*, Zhong Jin*, Polynuclear Cobalt Cluster Based Coordination Polymers for Efficient Nitrate-to-Ammonia Electroreduction. J. Am. Chem. Soc., 2024, 146, 20439-20448.

[24] Xuefeng Jiang, Sanzhong Luo, Kuangbiao Liao, Shan Jiang, Jing Ma, Jun Jiang, Zhigang Shuai, Artificial intelligence and automation to power the future of chemistry, Cell Reports Physical Science, 2024, 5, 102049.

[23] Tianrui Liu#, Qiantu Tao#, Yufei Wang, Rengan Luo, Jing Ma*, Jianping Lei*, Tailored Cis–Trans Isomeric Metal–Covalent Organic Frameworks for Coordination Configuration-Dependent Electrochemiluminescence. J. Am. Chem. Soc., 2024, 146, 18958-18966.

[22] Kui Xu#, Lifeng Zheng#, Song-Song Bao, Jing Ma*, Xiaoji Xie*, Li-Min Zheng*, Lanthanide-Sensitized Upconversion Iridium Complex via Triplet Energy Transfer. Small Methods, 2024, 2400671.

[21] Guoqun Zhang#, Lulu Fu#, Yuan Chen, Kun Fan, Chenyang Zhang, Huichao Dai, Linnan Guan, Minglei Mao, Jing Ma*, Chengliang Wang*, Hofmeister Effects in Supramolecular Chemistry for Anion-Modulation to Stabilize Zn Anode. Adv. Mater., 2024, 36, 2405949.

[20] Jie Chen#, Yanpeng Liu#, Baoquan Xiao, Juanjuan Huang, Hongwei Chen, Kun Zhu, Junkai Zhang, Guozhong Cao, Guanjie He*, Jing Ma*, Shanglong Peng*, Using MXene as a Chemically Induced Initiator to Construct High-Performance Cathodes for Aqueous Zinc-Ion Batteries. Angew. Chem. Int. Ed., 2024, 63, e202408667.

[19] Shengtang Liu#, Bailin Tian#, Xinrui Xu#, Xinzhu Wang#, Pan Ran, Yamei Sun, Jianghua Wu, Aoqian Qiu, Fangyuan Wang, Lingyu Tang, Jing Ma*, and Mengning Ding*, Ampere-Level Electrolytic Coproduction of Formate with Coupled Carbon Dioxide Reduction and Selective Methanol Oxidation. ACS Catal., 2024, 14, 9476-9486.

[18] Miao Wang#, Yating Gu#, Huaizhu Wang, Mengfei Zhu, Junchuan Liang, Zuoxiu Tie, Jing Ma*, Zhong Jin*, In situ self-assembled bismuth oxide fractals enabling highly selective electrosynthesis of formate in flow cells at high current densities. Nano Energy, 2024, 126, 109659.

[17] Xiangfeng Meng#, Yue Zhou#, Lei Xu, Limu Hu, Changjiang Wang, Xiao Tian, Xiang Zhang, Yi Hao, Bo Cheng, Jing Ma*, Lei Wang*, Jialin Liu*, Ran Xie*, O-GlcNAcylation Facilitates the Interaction between Keratin 18 and Isocitrate Dehydrogenases and Potentially Influencing Cholangiocarcinoma Progression. ACS Cent. Sci. 2024, 10, 1065-1083.

[16] Guoyang Zhang#, Qiang Zhu#, Hongcen Zheng, Shujuan Zhang*, Jing Ma*, Prediction of free radical reactions toward organic pollutants with easily accessible molecular descriptors. Chemosphere, 2024, 346, 140660.

[15] Xiaocheng Zhou#, Yaoda Wang#, Yuming Gu#, Jian Su, Yifan Liu, Ya Yin, Shuai Yuan*, Jing Ma*, Zhong Jin*, Jing-Lin Zuo*, All-Purpose Redox-Active Metal–Organic Frameworks as Both Cathodic and Anodic Host Materials for Advanced Lithium-Sulfur Batteries. Matter, 2024, 7, 3069-3082.

[14] Cheng Liu#, Cheng Fu#, Lingyu Tang, Jianghua Wu, Zhangyan Mu, Yamei Sun, Yanghang Pan, Bailin Tian, Kai Bao, Jing Ma*, Qiyuan He*, Mengning Ding*, Molecular transistor based on intermolecular charge transport through pi-pi stacking. Nano Res., 2024, 17, 4573-4581.

[13] Qizhou Chen#, Yuming Gu#, Haomin Fu#, Rengan Luo, Da Zhu, Pengfei Dong, Jing Ma*, Huangxian Ju, Jianping Lei*, Ultrastable Anion Radicals in Ligand-Dimerized Frameworks for Self-Accumulated Electrochemiluminescence. ACS Appl. Mater. Interfaces, 2024, 16, 18194-18201.

[12] Chaonan Cui, Hanyu Zhang, Yuming Gu, Lijun Geng, Yuhan Jia, Shiquan Lin, Jing Ma*, Zhixun Luo*, Tailoring Titanium Carbide Clusters for New Materials: from Met-Cars to Carbon-Doped Superatoms. J. Am. Chem. Soc., 2024, 146, 9302-9310.

[11] Kaiqiang Zhang#, Yang Ge#, Qianchuan Yu, Pengbo Zhang, Yuge Feng, Zuoxiu Tie, Jing Ma*, Zhong Jin*, Self-stratified aqueous biphasic Zn–I and Zn–Br batteries enabled by spontaneous phase separation and halogen extraction effects of ionic liquids. Energy Storage Mater., 2024, 67, 103296.

[10] Xiaoxiao Meng#, Lifeng Zheng#, Rengan Luo#, Weisu Kong, Zhiyuan Xu, Pengfei Dong, Jing Ma*, and Jianping Lei*, Bimodal Oxidation Electrochemiluminescence Mechanism of Coreactant-Embedded Covalent Organic Frameworks via Postsynthetic Modification. Angew. Chem. Int. Ed., 2024, 63, e202402373.

[9] Qiao Yuan#, Yating Gu#, Xingju Li#, Yangming Ding, Hongyu Chen, Xiangen Song*, Jiali Mu, Bin Li, Yutong Cai, Yue Zhang, Siquan Feng, Zheng Jiang, Li Yan, Jing Ma*, Yunjie Ding*, Single-site palladium on sulfur-doped carbon for olefin alkoxycarbonylation: Performance determined by coordination environments. Chem Catal., 2024, 4, 100830.

[8] Xinmei Song, Yang Ge, Hao Xu, Songsong Bao, Lei Wang, Xiaolan Xue, Qianchuan Yu, Yizhi Xing, Zuoao Wu, Kefeng Xie, Tangsong Zhu, Pengbo Zhang, Yuzhu Liu, Zhangjian Wang, Zuoxiu Tie, Jing Ma*, Zhong Jin*, Ternary Eutectic Electrolyte Assisted Formation and Dynamic Breathing Effect of Solid-Electrolyte Interphase for High-Stability Aqueous Magnesium-Ion Full Batteries. J. Am. Chem. Soc., 2024, 146, 7018-7028.

[7] Yuming Gu#, Shisi Tang#, Xu Liu, Xinyi Liang, Qin Zhu, Hongfeng Wu, Xiao Yang, Weihao Jin, Hongwei Chen, Chunyan Liu*, Yan Zhu*, Jing Ma*, Stability Prediction of Gold Nanoclusters with Different Ligands and Doped Metals: Deep Learning and Experimental Tests. J. Mater. Chem. A, 2024, 12, 4460-4472. (Hot Paper)

[6] Qin Zhu#, Yating Gu#, Xinzhu Wang, Yuming Gu, Jing Ma*, The synergistic effect between metal and sulfur vacancy to boost CO2 reduction efficiency: A study on descriptor transferability and activity prediction. JACS Au, 2024, 4, 125-138.

[5] Yuzhu Liu, Pengbo Zhang, Zuoao Wu, Guochun Ding, Xinmei Song, Jing Ma, Wei Wang, Xi-Zhang Wang, Zhong Jin*, Biomimetic Naphthoquinone Zwitterion Derivative with Water-Solubilizing Amino Acid Side Chain for High-Stability Aqueous Redox Flow Batteries. ACS Energy Lett., 2024, 9, 586-593.

[4] Yuzhu Liu, Pengbo Zhang, Zuoao Wu, Jie Wei, Guochun Ding, Xinmei Song, Jing Ma, Wei Wang, Zhong Jin*, Screening Ultra-Stable (Phenazine)dioxyalkanocic Acids with Varied Water-Solubilizing Chain Lengths for High-Capacity Aqueous Redox Flow Batteries. J. Am. Chem. Soc., 2024, 146, 3293-3302.

[3] Miao Wang#, Huaizhu Wang#, Yating Gu#, Mengfei Zhu, Mohan Kumar, Junchuan Liang, Zuoxiu Tie, Jing Ma*, Zhong Jin*, In Situ Generation of Flash Graphene Supported Spherical Bismuth Nanoparticles in Less than 200 ms for Highly Selective Carbon Dioxide Electroreduction. ACS Mater. Lett., 2024, 6, 100–108.

[2] Taoyi Kong, Junjie Li, Wei Wang, Xing Zhou, Yihua Xie, Jing Ma, Xianfeng Li*, Yonggang Wang*, Enabling Long-life Aqueous Organic Redox Flow Batteries with a Highly stable, Low Redox Potential Phenazine Anolyte. ACS Appl. Mater. Interfaces, 2024, 16, 752-760.

[1] Linke He#, Yulong Fu#, Shaoyi Hou#, Guoqiang Wang*, JiaBao Zhao, Yipeng Xing, Shuhua Li, Jing Ma*, Reaction Condition- and Functional Group-Specific Knowledge Discovery: Data- and Computation-based Analysis on Transition-Metal-Free Transformation of Organoborons. Artif. Intell. Chem., 2024, 2, 100034.

[1] Wei Li, Guoqiang Wang, Jing Ma*, Deep Learning for Complex Chemical systems. Natl. Sci. Rev., 2023, 10, nwad335.

[2] Manli Fu#, Yuan Chen#, Weihao Jin#, Huichao Dai, Guoqun Zhang, Kun Fan, Yanbo Gao, Linnan Guan, Jizhou Chen, Chenyang Zhang, Jing Ma,* Chengliang Wang*, A donor–acceptor (D–A) conjugated polymer for fast storage of anions. Angew. Chem. Int. Ed., 2023, 63, e202317393.

[3] Yuli Lei, Xiaoyu Xie*, Haibo Ma*, Jing Ma*, Vitality of Intralayer Vibration in hBN for Effective Long-Range Interlayer Hole Transfer across High Barriers in MoSe2/hBN/WSe2 Heterostructures. J. Phys. Chem. Lett., 2023, 14, 11190–11199.

[4] Xin Huang, Xuan Qiu, Wei Wang, Junjie Li, Zhi Li, Xiaomeng Yu, Jing Ma, Yonggang Wang*, Activating Organic Electrode via Trace Dissolved Organic Molecules. J. Am. Chem. Soc., 2023, 145, 25604-25613.

[5] Yi Hu#, Junchuan Liang#, Yuming Gu#, Songyuan Yang#, Wenjun Zhang, Zuoxiu Tie, Jing Ma*, Zhong Jin*, Sandwiched Epitaxy Growth of 2D Single-Crystalline Hexagonal Bismuthene Nanoflakes for Electrocatalytic CO2 Reduction. Nano Lett., 2023, 23, 10512-10521.

[6] Jia-Ge Jia#, Chen-Chen Zhao#, Yi-Fan Wei, Zhi-Min Zhai, Song-Song Bao, Allan J. Jacobson, Jing Ma*, Li-Min Zheng*, Macroscopic Helical Assembly of One-Dimensional Coordination Polymers: Helicity Inversion Triggered by Solvent Isomerism. J. Am. Chem. Soc., 2023, 145, 23948–23962.

[7] Liuzhou Gao#, Xinyi Liang#, Linke He#, Guoao Li, Shengda Chen, Jia Cao, Jing Ma, Guoqiang Wang*, Shuhua Li*, Base-mediated C–B bond activation of benzylic boronate for the rapid construction of β-silyl/boryl functionalized 1,1-diarylalkanes from aromatic alkenes. Chem. Sci., 2023, 14, 11881-11889.

[8] Mingguang Pan, Wei Wang, Huaizhu Wang, Jing Ma, Minhua Shao*, Zhong Jin*, High-voltage and durable pH-neutral aqueous redox flow batteries based on quaternary ammonium cations functionalized naphthalene diimide and nitroxyl radical systems. J. Power Sources, 2023, 580, 233269.

[9] Jun-Lin Wang, Hai-Zhen Wei*, M.R. Palmer, A.E. Williams-Jones, Jing Ma, Shao-Yong Jiang, Simon V. Hohl, Yuan-Feng Zhu, Chun Huan, Miao-Miao Zhang, Jian-Jun Lu, Barium isotope fractionation during granitic magmatism and potential of δ138/134 Ba for distinguishing magmatic-hydrothermal transition in granitic magma systems. Geochimica et Cosmochimica Acta, 2023, 360, 138-150.

[10] Yang Ge, Xueping Wang, Qiang Zhu, Yuqin Yang, Hao Dong, Jing Ma*, Machine Learning-Guided Adaptive Parameterization for Coupling Terms in a Mixed United-atom/Coarse-Grained Model for Diphenylalanine Self-assembly in Aqueous Ionic Liquids. J. Chem. Theory Comput., 2023, 19, 6718–6732.

[11] Ya-Ting Gu, Yu-Ming Gu*, Qiantu Tao, Xinzhu Wang, Qin Zhu, Jing Ma*, Machine Learning for Prediction of CO2/N2/H2O Selective Adsorption and Separation in Metal-zeolites. J. Mater. Inf., 2023, 3, 19.

[12] Weisu Kong, Da Zhu, Yong Zhang, Rengan Luo, Jing Ma*, Jianping Lei, Huangxian Ju*, Electron Donor Coordinated Metal-Organic Framework to Enhance Photoelectrochemical Performance. Angew. Chem. Int. Ed., 2023, 62, e202308514.

[13] Pengfei Dong#, Yuming Gu#, Rengan Luo, Gehua Wen, Songsong Bao*, Jing Ma*, Jianping Lei*, A Self-Templated Design Approach toward Multivariate Metal-Organic Frameworks for Enhanced Oxygen Evolution. Small, 2023, 19, 2301473.

[14] Ziran Liu#, Qian Li#, Lulu Fu#, Jide Wang, Jing Ma*, Chunfeng Zhang*, Rui Wang*, Excited-State Dynamics in All-polymer Blends with Polymerized Small-Molecule Acceptors. Adv. Sci., 2023, 10, 2301931.

[15] Jincheng Zou#, Cheng Fu#, Yong Zhang#, Kun Fan, Yuan Chen, Chenyang Zhang, Guoqun Zhang, Huichao Dai, Yueyue Cao, Jing Ma*, Chengliang Wang*, A Novel Hexaazatriphenylene Carboxylate with Compatible Binder as Anode for High-Performance Organic Potassium-Ion Batteries. Adv. Funct. Mater., 2023, 33, 2303678.

[16] Kun Fan#, Jian Li#, Yongshan Xu, Cheng Fu, Yuan Chen, Chenyang Zhang, Guoqun Zhang, Jing Ma, Tianyou Zhai, Chengliang Wang*, Single crystals of a highly conductive three-dimensional conjugated coordination polymer. J. Am. Chem. Soc., 2023, 145, 12682-12690.

[17] Yang Lv#, Si-Wen Ke#, Yuming Gu#, Bailin Tian, Lingyu Tang, Pan Ran, Yue Zhao, Jing Ma*, Jing-Lin Zuo*, Mengning Ding*, Highly Efficient Electrochemical Nitrate Reduction to Ammonia in Strong Acid Condition with Fe2M-Trinuclear-Cluster Metal-Organic Frameworks. Angew. Chem. Int. Ed., 2023, 62, e202305246.

[18] Guoqun Zhang#, Yuan Chen#, Lulu Fu#, Lifeng Zheng, Kun Fan, Chenyang Zhang, Jincheng Zou, Huichao Dai, Linnan Guan, Yueyue Cao, Minglei Mao, Jing Ma*, Chengliang Wang*, Regulating the Solvation Sheath of Zinc Ions by Supramolecular Coordination Chemistry towards Ultra-Stable Zinc Anodes. SmartMat, 2024, 5, e1216.

[19] Lulu Fu#, Ranran Wang#, Qiang Zhu#, Yuming Gu, Li-Feng Zheng, Yuan Chen, Juli Jiang*, Jing Ma*, Planar Chirality for Acid/Base Responsive Macrocyclic Pillararenes Induced by Amino Acid Derivatives: Molecular Dynamics Simulations and Machine Learning. J. Chem. Theory Comput., 2023, 19, 4364-4376.

[20] Guoqiang Wang#, Xuefei Wu#, Bo Xin#, Xu Gu, Gaobo Wang, Yong Zhang, Jiabao Zhao, Xu Cheng, Chunlin Chen*, Jing Ma*, Machine Learning in Unmanned Systems for Chemical Synthesis. Molecules, 2023, 28, 2232.

[21] Fangyuan Wang#, Yuming Gu#, Bailin Tian, Yuxia Sun, Lifeng Zheng, Shengtang Liu, Yiqi Wang, Lingyu Tang, Xiao Han, Jing Ma*, Mengning Ding*, Spinel-Derived Formation and Amorphization of Bimetallic Oxyhydroxides for Efficient Electrocatalytic Biomass Oxidation. J. Phys. Chem. Lett., 2023, 14, 2674-2683.

[22] Qin Zhu, Shuoqi Zhang, Jing Ma, Jun Zhu*, Shuhua Li*, Guixiang Zeng*. Catalytic Mechanisms of Transfer Hydrogenation of Azobenzene with Ammonia Boraneby Pincer Bismuth Complex: Crucial Role of C=N Functional Group on the Pincer Ligand. Chem Asian J., 2023, 18, e202201069.

[23] Yanrong Wang*, Caixing Wang, Wei Wang, Yu Zhang, Zhaowei Guo, Jianhang Huang, Lei Yan, Jing Ma, Yonggang Wang*, Organic Hydronium-ion Battery with Ultra-long Life. ACS Energy Lett., 2023, 8, 1390-1396.

[24] Hongwei Chen#, Junlin Wang#, A.E. Willaims-Jones, Qin Zhu, Lifeng Zheng, Chenchen Zhao, Ziteng Liu, Weigao Xu, Haizhen Wei*, Lin Guo*, Jing Ma*, Effects of Carbonate Species and Chloride Ions in Calcium Phosphate Nucleation of Biological Apatite. Sci. China Mater., 2023, 66, 2872-2884.

[25] Yan Xiong#, Bang Li#, Yuming Gu#, Tong Yan, Zhigang Ni, Shuhua Li, Jing-Lin Zuo*, Jing Ma*, Zhong Jin*, Photocatalytic nitrogen fixation under an ambient atmosphere using a porous coordination polymer with bridging dinitrogen anions. Nat. Chem., 2023, 15, 286-296.

[26] Ming-Feng Qin#, Li-Feng Zheng#, Song-Song Bao, Fei-Hu Xue, Jian Su, Jing Ma*, Li-Min Zheng*, Metalloporphyrinyl-Phosphonates with Serrated Chain Structures: Exfoliation and NIR Photothermal Effect. ACS Appl. Electron. Mater., 2023, 5, 887-895.

[27] Hao Zheng#, Lulu Fu#, Ranran Wang, Jianmin Jiao, Yingying Song, Conghao Shi, Yuan Chen, Juli Jiang*, Chen Lin*, Jing Ma*, Leyong Wang, Cation controlled rotation in anionic pillar[5] arenes and its application for fluorescence switch. Nat. Commun, 2023, 14, 590.

[28] Si-Wen Ke#, Wei Li#, Yuming Gu#, Jian Su, Yifan Liu, Shuai Yuan, Jing-Lin Zuo*, Jing Ma*, Ping He*, Covalent Organic Frameworks with Ni–Bis(dithiolene) and Co–Porphyrin Units as Bifunctional Catalysts for Li–O2 Batteries. Sci. Adv., 2023, 9, eadf2398.

[29] Yuzhu Liu, Ge-Hua Wen, Junchuan Liang, Song-Song Bao, Jie Wei, Huaizhu Wang, Pengbo Zhang, Mengfei Zhu, Qingqing Jia, Jing Ma, Li-Min Zheng*, Zhong Jin*, Aqueous Colloid Flow Batteries Based on Redox-Reversible Polyoxometalate Clusters and Size-Exclusive Membranes. ACS Energy Lett., 2023, 8, 387–397.

[30] Qiang Zhu, Yang Ge, Wei Li*, Jing Ma*, Treating Polarization Effects in Charged and Polar Bio-Molecules Through Variable Electrostatic Parameters. J. Chem. Theory Comput., 2023, 19, 396-411.

[31] Lulu Fu, Haixia Hu, Qiang Zhu, Lifeng Zheng, Yuming Gu, Yaping Wen, Haibo Ma, Hang Yin*, Jing, Ma*, Machine Learning Assisted Prediction of Charge Transfer Properties in Organic Solar Cells by Using Morphology-related Descriptors. Nano Res., 2023, 16, 3588-3596.

[32] Weilin Chen#, Lulu Fu#, Zhiqiang Zhu, Jingyan Liu, Linxiu Cheng, Zhou Xu, Hao Dong*, Jing Ma, Yibao Li*, Xiaolin Fan, Synergistic regulation of intermolecular interactions to control chiral structures for chiral recognition. Chin. Chem. Lett., 2023, 34, 107713.

[33] Haixia Hu, Xinyu Mu, Bin Li, Ruohua Gui, Rui Shi, Tao Chen, Jianqiang Liu, Jianyu Yuan*, Jing Ma, Kun Gao*, Xiaotao Hao*, Hang Yin*, Desirable Uniformity and Reproducibility of Electron Transport in Single-Component Organic Solar Cells. Adv. Sci., 2023, 10, 2205040.

[34] Kun Fan, Cheng Fu, Yuan Chen, Chenyang Zhang, Guoqun Zhang, Linnan Guan, Minglei Mao, Jing Ma, Wenping Hu, Chengliang Wang*, Framework Dimensional Control Boosting Charge Storage in Conjugated Coordination Polymers. Adv. Sci., 2023, 10, 220576.

[1] Yang Lv#, Jian Su#, Yuming Gu#, Bailin Tian, Jing Ma*, Jing-Lin Zuo*, Mengning Ding*, Atomically Precise Integration of Multiple Functional Motifs in Catalytic Metal-Organic Frameworks for Highly Efficient Nitrate Electroreduction. JACS Au, 2022, 2, 2765-2777.

[2] Jiahui Du, Kang Liao, Jing Ma, Wei Li*, Shuhua Li*, Generalized Energy-Based Fragmentation Approach for the Electronic Emission Spectra of Large Systems. J. Chem. Theory Comput., 2022, 18, 7630–7638.

[3] Shengtang Liu#, Bailin Tian#, Xinzhu Wang#, Yamei Sun, Yiqi Wang, Jing Ma*, Mengning Ding*, The Critical Role of Initial/Operando Oxygen Loading in General Bismuth-Based Catalysts for Electroreduction of Carbon Dioxide. J. Phys. Chem. Lett., 2022, 13, 9607–9617.

[4] Qingqing Jia, Yifan Ni, Ziteng Liu, Xu Gu, Ziyi Cui, Mengting Fan, Qiang Zhu*, Yi Wang*, Jing Ma*, Fast Prediction of Lipophilicity of Organofluorine Molecules: Deep Learning Derived Polarity Characters and Experimental Tests. J. Chem. Inf. Model., 2022, 62, 4928–4936.

[5] Ke Wang, Jing Ma, Haibo Ma*, Characterizing the excited states of large photoactive systems by exciton models. J. Chin. Chem. Soc., 2022, 1–16.

[6] Qin Zhu#, Yuming Gu#, Xinyi Liang, Xinzhu Wang, Jing Ma*, A Machine Learning Model to Predict CO2 Reduction Reactivity and Products Transferred from Metal-Zeolites. ACS Catal., 2022, 12, 12336−12348.

[7] Xiong Li, Lifeng Zheng, Wei Tang, Shanghui Ye, Jing Ma, Hongji Jiang*, Synthesis and excited state modulation of organic blue light emitters based on 2,4,6-triphenyl-1,3,5-triazine and carbazole derivatives through ortho positioned linking models. New J. Chem., 2022, 46, 16121.

[8] Wei-Hua Yuan*, Li-Feng Zheng, Li-Yuan Zhuang, Yan-Xia Zhao, Qian-Yu Wu, Qian Li, Sheng-Liang Zhou, Jian Tang, Hong-Lei Li, Chun-Li Zhang, Yue Wang, Jing Ma*, Fluorescent Talarolactones from Talaromyces sp. Chem. Biodiversity, 2022, 19, e202200645.

[9] Qiang Zhu, Qingqing Jia, Ziteng Liu, Yang Ge, Xu Gu, Ziyi Cui, Mengting Fan, Jing Ma*, Molecular Partition Coefficient from Machine Learning with Polarization and Entropy Embedded Atom-Centered Symmetry Functions. Phys. Chem. Chem. Phys., 2022, 24, 23082. (Hot Paper)

[10] Lei Yan*, Qiang Zhu, Yae Qi, Jie Xu, Yu Peng, Jie Shu, Jing Ma, Yonggang Wang*, Towards High-Performance Aqueous Zinc Batteries via a Semi-Conductive Bipolar-Type Polymer Cathode. Angew. Chem. Int. Ed., 2022, e202211107.

[11] Shi-Hai Yan, Li-Mu Hu, Xue-Hui Hao, Jiang Liu, Xi-Ying Tan, Zhi-Rong Geng*, Jing Ma*, Zhi-Lin Wang*, Chemoproteomics reveals berberine directly binds to PKM2 to inhibit the progression of colorectal cancer. iScience, 2022, 8, 104773.

[12] Yu Zhang#, Chenchen Zhao#, Zhi Li, Yanrong Wang, Lei Yan, Jing Ma, Yonggang Wang*, Synergistic co-reaction of Zn2+ and H+ with carbonyl groups towards stable aqueous zinc-organic batteries. Energy Storage Mater., 2022, 52, 386-394.

[13] Shi-Qing Wang#, Xinzhu Wang#, Xiao-Mei Cheng, Jing Ma*, Wei-Yin Sun*, Tailoring Defect-Type and Ligand-Vacancy in Zr(IV) Frameworks for CO2 Photoreduction. J. Mater. Chem. A, 2022, 10, 16396-16402.

[14] Minghang Jiang#, Qiang Zhu#, Xinmei Song, Yuming Gu, Pengbo Zhang, Changqing Li, Jianxun Cui, Jing Ma, Zuoxiu Tie*, Zhong Jin*, Batch-Scale Synthesis of Nanoparticle-Agminated Three-Dimensional Porous Cu@Cu2O Microspheres for Highly Selective Electrocatalysis of Nitrate to Ammonia. Environ. Sci. Technol., 2022, 56, 10299−10307.

[15] Yuming Gu#, Qin Zhu#, Ziteng Liu#, Cheng Fu, Jiayue Wu, Qiang Zhu, Qingqing Jia, Jing Ma*, Nitrogen Reduction Reaction Energy and Pathway in Metal-zeolites: Deep Learning and Explainable Machine Learning with Local Acidity and Hydrogen Bonding Features. J. Mater. Chem. A, 2022, 10, 14976-14988.

[16] Yanghang Pan#, Xinzhu Wang#, Weiyang Zhang, Lingyu Tang, Zhangyan Mu, Cheng Liu, Bailin Tian, Muchun Fei, Yamei Sun, Huanhuan Su, Libo Gao, Peng Wang, Xiangfeng Duan*, Jing Ma*, Mengning Ding*, Boosting the performance of single-atom catalysts via external electric field polarization. Nat. Commun., 2022, 13, 3063.

[17] Zengyu Li#, Qingqing Jia#, Yuan Chen, Kun Fan, Chenyang Zhang, Guoqun Zhang, Ming Xu, Minglei Mao, Jing Ma*, Wenping Hu, Chengliang Wang*, A Small Molecular Symmetric All-Organic Lithium-Ion Battery. Angew. Chem. Int. Ed., 2022, 61, e202207221.

[18] Yuli Lei, Zhenfa Zheng, Luis Vasquez*, Jin Zhao, Jing Ma, Haibo Ma*, Enhanced Electron Transfer and Spin Flip through Spin–Orbital Couplings in Organic/Inorganic Heterojunctions: A Nonadiabatic Surface Hopping Simulation. J. Phys. Chem. Lett., 2022, 13, 4840−4848.

[19] Bingqian Liu#, Qin Zhu#, Yanghang Pan#, Futao Huang, Lingyu Tang, Cheng Liu, Zheng Cheng, Peng Wang, Jing Ma*, Mengning Ding*, Single-Atom Tailoring of Two-Dimensional Atomic Crystals Enables Highly Efficient Detection and Pattern Recognition of Chemical Vapors. ACS Sens., 2022, 7, 1533−1543.

[20] Cheng Jiang#, Lulu Li#, Qingqing Jia, Mi Tang, Kun Fan, Yuan Chen, Chenyang Zhang, Minglei Mao, Jing Ma, Wenping Hu, Chengliang Wang*, In Situ Synthesis of Organopolysulfides Enabling Spatial and Kinetic Co-Mediation of Sulfur Chemistry. ACS Nano, 2022, 16, 9163–9171.

[21] Jiahui Du, Yixuan Ma, Jing Ma, Shuhua Li, Wei Li*, Transition Orbital Projection Approach for Excited State Tracking. J. Chem. Phys., 2022, 156, 214104.

[22] Wendong Jia, Chengzhen Hu, Yuqin Wang, Yao Liu, Liying Wang, Shanyu Zhang, Qiang Zhu, Yuming Gu, Panke Zhang, Jing Ma, Hong-Yuan Chen, Shuo Huang*, Identification of Single-Molecule Catecholamine Enantiomers Using a Programmable Nanopore. ACS Nano, 2022, 16, 6615−6624.

[23] Qin Zhu#, Yuming Gu#, Xinzhu Wang, Chenyang Zhang*, Jing Ma*, Discovery of Electronic Structure and Interfacial Interaction Features in Catalytic Activity. Langmuir, 2022, 38, 3959–3968.

[24] Jun-Lin Wang, Hai-Zhen Wei*, A.E. Williams-Jones, Ge Dong, Yuan-Feng Zhu, Shao-Yong Jiang, Jing Ma, Simon V. Hohl, Xi Liu, Yin-Chuan Li, Jian-Jun Lu, Silver isotope fractionation in ore-forming hydrothermal systems. Geochimica et Cosmochimica Acta, 2022, 322, 24−42.

[25] Mingguang Pan, Liuzhou Gao, Junchuan Liang, Pengbo Zhang, Shuyu Lu, Yan Lu, Jing Ma, Zhong Jin*, Reversible Redox Chemistry in Pyrrolidinium-Based TEMPO Radical and Extended Viologen for High-Voltage and Long-Life Aqueous Redox Flow Batteries. Adv. Energy Mater., 2022, 2103478.

[26] Hongwei Chen#, Changchang Lv#, Lin Guo*, Ming Ma, Xiangfeng Li, Zhengyi Lan, Jun Huo, Hao Dong, Xiangdong Zhu, Qiang Zhu, Yuming Gu, Ziteng Liu, Jianjun Liu, Hangrong Chen, Xuefeng Guo*, Jing Ma*, Surface Stability and Morphology of Calcium Phosphate Tuned by pH Values and Lactic Acid Additives: Theoretical and Experimental Study. ACS Appl. Mater. Interfaces, 2022, 14, 4836–4851.

[27] Yang Ge#, Qiang Zhu#, Yunzhi Li, Hao Dong*, Jing Ma*, An electrostatic-variable coarse-grained model for predicting enthalpy of vaporization, surface tension, diffusivity, conductivity, and dielectric constant of aqueous ionic liquid. J. Mol. Liq., 2022, 346, 118230.

[28] Shi-Qing Wang, Xu Gu, Xinzhu Wang, Xiao-Yu Zhang, Xiao-Yao Dao, Xiao-Mei Cheng, Jing Ma*, Wei-Yin Sun*, Defect-engineering of Zr(IV)-based metal-organic frameworks for regulating CO2 photoreduction. Chem. Eng. J., 2022, 429, 132157.

[29] Zheng Cheng, Jiahui Du, Lei Zhang, Jing Ma*, Wei Li*, Shuhua Li*, Building quantum mechanics quality force fields of proteins with the generalized energy-based fragmentation approach and machine learning. Phys. Chem. Chem. Phys., 2022, 24, 1326–1337.

[30] Chenyang Zhang#, Yong Zhang#, Kun Fan#, Qian Zou, Yuan Chen, Yanchao Wu, Songsong Bao, Limin Zheng, Jing Ma*, Chengliang Wang*, Diradicals or Zwitterions: The Chemical States of m-Benzoquinone and Structural Variation after Storage of Li Ions. CCS Chem., 2022, 4, 2768–2781.

[1] Shi-Qing Wang#, Xinzhu Wang#, Xiao-Yu Zhang#, Xiao-Mei Cheng, Jing Ma*, Wei-Yin Sun*, Effect of the Defect Modulator and Ligand Length of Metal−Organic Frameworks on Carbon Dioxide Photoreduction. ACS Appl. Mater. Interfaces, 2021, 13, 61578−61586.

[2] Chuntao Chen#, Jieshu Qian#*, Hongwei Chen, Heng Zhang, Lei Yang, Xiaohong Jiang, Xuan Zhang, Xiaoyu Li, Jing Ma*, Dongping Sun*, Molecular Origin of the Biologically Accelerated Mineralization of Hydroxyapatite on Bacterial Cellulose for More Robust Nanocomposites. Nano Lett., 2021, 21, 10292−10300.

[3] Wei Li*, Haibo Ma*, Shuhua Li, Jing Ma*, Computational and data driven molecular material design assisted by low scaling quantum mechanics calculations and machine learning. Chem. Sci., 2021, 12, 14987–15006.

[4] Haixia Hu#, Lulu Fu#, Kangning Zhang, Kun Gao, Jing Ma*, Xiaotao Hao*, Hang Yin*, Observing halogen-bond-assisted electron transport in high-performance polymer solar cells. Appl. Phys. Lett., 2021, 119, 183302.

[5] Yanchao Wu#, Yong Zhang#, Yuan Chen#, Hui Tang#, Mi Tang, Shuaifei Xu, Kun Fan, Chenyang Zhang, Jing Ma*, Chengliang Wang*, Wenping Hu, Hetero-chelation boosting sodium storage in π-d conjugated coordination polymers. Energy Environ. Sci., 2021, 14, 6514–6525.

[6] Yan Xiong, Hongwei Chen, Yi Hu, Songyuan Yang, Xiaolan Xue, Lingfeng He, Xu Liu*, Jing Ma*, Zhong Jin*, Photo-Driven Catalytic Hydrogenation of CO2 to CH4 with nearly 100% Selectivity over Ag25 Clusters. Nano Lett., 2021, 21, 8693-8700.

[7] Jia-Ge Jia#, Chen-Chen Zhao#, Song-Song Bao, Lan-Qing Wu, Ge-Hua Wen, Allan J. Jacobson, Jing Ma*, Li-Min Zheng*, Layer or Tube? Uncovering Key Factors Determining the Rolling-up of Layered Coordination Polymers. J. Am. Chem. Soc., 2021, 143, 17587-17598.

[8] Yi Hu, Xinzhu Wang, Zhenghang Qi, Susu Wan, Junchuan Liang, Qingqing Jia, Daocheng Hong, Yuxi Tian, Jing Ma*, Zuoxiu Tie, Zhong Jin*, Wet Chemistry Vitrification and Metal-to-Semiconductor Transition of 2D Gray Arsenene Nanoflakes. Adv. Funct. Mater., 2021, 2106529.

[9] Ziteng Liu, Yinghuan Shi, Hongwei Chen, Tiexin Qin, Xuejie Zhou, Jun Huo, Hao Dong, Xiao Yang, Xiangdong Zhu, Xuening Chen, Li Zhang, Mingli Yang, Yang Gao*, Jing Ma*, Machine learning on properties of multiscale multisource hydroxyapatite nanoparticles datasets with different morphologies and sizes. npj Comput. Mater., 2021, 7, 142.

[10] Ziteng Liu, Liqiang Lin, Qingqing Jia, Zheng Cheng, Yanyan Jiang, Yanwen Guo*, Jing Ma*, Transferable Multilevel Attention Neural Network for Accurate Prediction of Quantum Chemistry Properties via Multitask Learning. J. Chem. Inf. Model., 2021, 61, 1066-1082.

[11] Qiang Zhu#, Yuming Gu#, Limu Hu#, Théophile Gaudin, Mengting Fan, Jing Ma*, Shear viscosity prediction of alcohols, hydrocarbons, halogenated, carbonyl, nitrogen-containing, and sulfur compounds using the variable force fields. J. Chem. Phys., 2021, 154, 074502.

[12]Fangjia Fu, Kang Liao, Ziteng Liu, Daocheng Hong, Haitang Yang, Yuxi Tian, Wei Wei, Chungen Liu, Shuhua Li, Jing Ma*, Wei Li*, Controlled Fluorescence Enhancement of DNA-Binding Dye Through Chain Length Match between Oligoguanine and TOTO. J. Phys. Chem. B, 2021, 125, 518-527.

[13]Congyue Liu, Yuming Gu, Cheng Liu, Shengtang Liu, Xiaoshan Li, Jing Ma, Mengning Ding*, Missing-Linker 2D Conductive Metal Organic Frameworks for Rapid Gas Detection. ACS Sens., 2021, 6, 429-438.

[14]Xiaolan Xue#, Hongwei Chen#, Yan Xiong, Renpeng Chen, Minghang Jiang, Gao Fu, Zhonghua Xi, Xiao Li Zhang, Jing Ma*, Weihai Fang, Zhong Jin*, Near-Infrared-Responsive Photo-Driven Nitrogen Fixation Enabled by Oxygen Vacancies and Sulfur Doping in Black TiO2−xSy Nanoplatelets. ACS Appl. Mater. Interfaces, 2021, 13, 4975-4983.

[15]Ningning Feng, Bingliang Wang, Zhuo Yu, Yuming Gu, Lili Xu, Jing Ma, Yonggang Wang*, Yongyao Xia*, Mechanism-of-Action Elucidation of Reversible Li-CO2 Batteries Using the Water-In-Salt Electrolyte. ACS Appl. Mater. Interfaces, 2021, 13, 7396-7404.

[16]Yuan Chen#, Lulu Fu#, Baobao Sun, Cheng Qian, Srikala, Pangannaya, Hong Zhu, Jing Ma, Juli Jiang*, Zhigang Ni*, Ruibing Wang, Xiancai Lu, Leyong Wang*, Selection of Planar Chiral Conformations between Pillar[5,6]arenes Induced by Amino Acid Derivatives in Aqueous Media. Chem. Eur. J., 2021, 27, 1-8.

  1. Yajun Gao#, Lei Zhang#, Yuming Gu#, Wenwei Zhang, Yi Pan, Weihai Fang, Jing Ma*, Ya-Qian Lan*, Junfeng Bai*, Formation of a Mixed-Valence Cu(I)/Cu(II) Metal-Organic Framework with the Full Light Spectrum and High Selectivity of CO2 Photoreduction into CH4. Chem. Sci. 2020, 11, 10143–10148.
  2. Shuohao Li#, Hongwei Chen#, Xu Liu, Haoqi Liu, Jing Ma*, Yan Zhu*, The precise editing of surface sites on a molecular-like gold catalyst for modulating regioselectivity. Chem. Sci. 2020, 11, 8000-8004.
  3. Yajun Gao#, Mingxing Zhang#, Cong Chen, Yong Zhang, Yuming Gu, Qian Wang, Wenwei Zhang, Yi Pan, Jing Ma, Junfeng Bai*, A low symmetry cluster meets a low symmetry ligand to sharply boost MOF thermal stability. Chem. Commun. 2020, 56, 11985-11988.
  4. Dong Zheng, Mengning Ding, Yi Hu, Jun Zhao, Chunyan Liu, Xiang Li, Pingying Liu, Zhong Jin, Jing Ma*, Promoting Z-to-E Thermal Isomerization of Azobenzene Derivatives by Noncovalent Interaction with Phosphorene: Theoretical Prediction and Experimental Study. J. Phys. Chem. C 2020, 124, 15961-15968.
  5. Zheng Cheng, Dongbo Zhao, Jing Ma, Wei Li*, Shuhua Li*, An On-the-fly Approach to Construct Generalized Energy‒Based Fragmentation Machine Learning Force Fields of Complex Systems. J. Phys. Chem. A 2020, 124, 5007-5014.
  6. Alice Di Pasquale, Stefano Tommasone, Lili Xu, Jing Ma, Paula M. Mendes*, Cooperative multipoint recognition of sialic acid by benzoboroxole‐based receptors bearing cationic hydrogen‐bond donors. J. Org. Chem. 2020, 85, 8330-8338.
  7. Jiaqi Tian, Gaobo Wang, Zheng-hang Qi, Jing Ma*, Ligand Effects of BrettPhos and RuPhos on Rate-Limiting Steps in Buchwald-Hartwig Amination Reaction Due to Modulation of Steric Hindrance and Electronic Structure. ACS Omega, 2020, 5, 21385-21391.
  8. Wenguang Huang, Xinzhu Wang, Wentao Zhang, Shujuan Zhang,* Yuxi Tian, Zhihao Chen, Weihai Fang, Jing Ma*, Intraligand charge transfer boosts visible-light-driven generation of singlet oxygen by metal-organic frameworks. Appl. Catal., B: Environ., 2020, 273, 119087. Learn More
  9. Yaping Wen, Lulu Fu, Gongqiang Li,* Jing Ma,* Haibo Ma*, Accelerated Discovery of Potential Organic Dyes for Dye-Sensitized Solar Cells by Interpretable Machine Learning Models and Virtual Screening. Sol. RRL 2020, 2000110.
  10. Yigao Yuan, Qiang Zhu, Ruiheng Song, Jing Ma, Hao Dong*, A Two-ended DAta-Driven Accelerated Sampling Method for Exploring the Transition Pathways between Two Known States of Protein. J. Chem. Theory Comput. 2020, 16, 4631-4640.
  11. Wenjun Zhang, Chenhong Xu, Yi Hu, Songyuan Yang, Lianbo Ma, Lei Wang, Peiyang Zhao, Caixing Wang, Jing Ma*, Zhong Jin*. Electronic and geometric structure engineering of bicontinuous porous Ag–Cu nanoarchitectures for realizing selectivity-tunable electrochemical CO2 reduction. Nano Energy 2020, 73, 104796.
  12. Shanchao Tan#, Hongyu Shi#, Lulu Fu, Jing Ma, Xin Du, Jian Song, Yuhong Liu,* Qingdao Zeng,* Haijun Xu,* Junhua Wan*, Superlubricity of Fullerene Derivatives Induced by Host−Guest Assembly. ACS Appl. Mater. Interfaces. 2020, 12, 18924-18933.
  13. Yuming Gu, Ziteng Liu, Changzhou Yu, Xu Gu, Lili Xu, Yang Gao,* Jing Ma*, Zeolite Adsorption Isotherms Predicted by Pore Channel and Local Environmental Descriptors: Feature Learning on DFT Binding Strength. J. Phys. Chem. C 2020, 124, 9314-9328. Learn More
  14. Xiuxiu Wang#, Yi Hu#, Jianbin Mo#, Jingyi Zhang, Zhenzhen Wang, Wei Wei, Huanlin Li, YunXu, Jing Ma, Jing Zhao,* Zhong Jin,* Zijian Guo*, Arsenene: A Potential Therapeutic Agent for Acute Promyelocytic Leukaemia Cells by Acting on Nuclear Proteins. Angew. Chem. Int. Ed. 2020, 59, 5151–5158.
  15. Yuan Chen#, Lulu Fu#, Baobao Sun, Cheng Qian, Ruibing Wang, Juli Jiang,* Chen Lin,* Jing Ma,* Leyong Wang, Competitive Selection of Conformation Chirality of Water-Soluble Pillar[5]arene Induced by Amino Acid Derivatives. Org. Lett. 2020, 22, 2266-2270.
  16. Yanrong Wang#，Ziteng Liu#，Caixing Wang#，Yi Hu，Huinan Lin，Weihua Kong，Jing Ma，Zhong Jin*，π-Conjugated Polyimide-Based Organic Cathodes with Extremely-Long Cycling Life for Rechargeable Magnesium Batteries. Energy Storage Materials. 2020, 26, 494-502.
  17. Mi Tang, Cheng Jiang, Shiyuan Liu, Xiang Li, YuanChen, Yanchao Wu, Jing Ma, Chengliang Wang*, Small amount COFs enhancing storage of large anions. Energy Storage Materials, 2020, 27, 35-42.
  18. Yanrong Wang, Caixing Wang, Zhigang Ni, Yuming Gu, Bingliang Wang, Zhaowei Guo, Zhuo Wang, Duan Bin, Jing Ma, Yonggang Wang*, Binding Zinc Ions by Carboxyl Groups from Adjacent Molecules toward Long‐Life Aqueous Zinc–Organic Batteries. Adv. Mater. 2020, 32, 2000338.
  19. Cheng Jiang#, Yuming Gu#, Mi Tang, Yuan Chen, Yanchao Wu, Jing Ma*, Chengliang Wang*, Wenping Hu, Toward Stable Lithium Plating/Stripping by Successive Desolvation and Exclusive Transport of Li Ions. ACS Appl. Mater. Interfaces 2020, 12, 10461−10470. Learn More
  20. Caixing Wang, Xiang Li, Bo Yu, Yanrong Wang, Zhen Yang, Huaizhu Wang, Huinan Lin, Jing Ma, Guigen Li, Zhong Jin*, Molecular Design of Fused-Ring Phenazine Derivatives for Long-Cycling Alkaline Redox Flow Batteries. ACS Energy Lett. 2020, 5(2), 411-417.
  21. Yin-Chuan Li, Hong-Wei Chen, Hai-Zhen Wei*, Shao-Yong Jiang*, Martin R.Palmer, T.G.M.van de Ven, Simon Hohl, Jian-Jun Lu, Jing Ma*, Exploration of driving mechanisms of equilibrium boron isotope fractionation in tourmaline group minerals and fluid: A density functional theory study. Chem. Geol., 2020, 536, 119466.
  1. Wei Li*, Mingzhou Duan, Kang Liao, Benkun Hong, Zhigang Ni, Jing Ma, Shuhua Li*, Improved Generalized Energy-Based Fragmentation Approach and Its Applications to the Binding Energies of Supramolecular Complexes. Electron. Struct. 2019, 1 (4), 044003.
  2. Tao Chen#, Weihua Kong#, Mengting Fan#, Zewen Wang, Lei Wang, Renpeng Chen, Yi Hu, Jing Ma*, Zhong Jin*, Chelation-assisted formation of multi-yolk–shell Co4N@carbon nanoboxes for self-discharge-suppressed high-performance Li–SeS2 batteries. J. Mater. Chem. A, 2019,7, 20302-20309.
  3. Qiang Zhu, Yigao Yuan, Jing Ma*, Hao Dong*, A Data-driven Accelerated Sampling Method for Searching Functional States of Proteins. Adv. Theory Simul. 2019, 1800171. Learn More
  4. Wen Yan, Caixing Wang, Jiaqi Tian, Guoyin Zhu, Lianbo Ma, Yanrong Wang, Renpeng Chen, Yi Hu, Lei Wang, Tao Chen, Jing Ma, Zhong Jin*, All-polymer particulate slurry batteries, Nat. Commun., 2019, 10, 2513.
  5. Dong Zheng, Yuming Gu, Xiang Li, Lizhu Zhang, Wei Zhao, Jing Ma*, Hydrogen Bonding Promoted Tautomerism between Azo and Hydrazone Forms in Calcon with Multistimuli Responsiveness and Biocompatibility. J. Chem. Inf. Model., 2019, 59, 2110-2122.
  6. Fangjia Fu, Kang Liao,Jing Ma, Zheng Cheng, Dong Zheng, Liuzhou Gao, Chungen Liu*, Shuhua Li, Wei Li*, How intermolecular interactions influence electronic absorption spectra: insights from the molecular packing of uracil in condensed phases. Phys. Chem. Chem. Phys., 2019, 21(7), 4072-4081.
  7. Zheng-Hang Qi#, Yi Hu#, Zhong Jin*, Jing Ma*, Tuning the liquid-phase exfoliation of arsenic nanosheets by interaction with various solvents, Phys. Chem. Chem. Phys., 2019, 21, 12087-12090.
  8. Yi Hu, Zheng-Hang Qi, Jingyu Lu, Renpeng Chen, Mingzhi Zou, Tao Chen, Wenjun Zhang, Yanrong Wang, Xiaolan Xue, Jing Ma*, Zhong Jin*, van der Waals Epitaxial Growth and Interfacial Passivation of Two-Dimensional Single-Grystalline Few-Layer Gray Arsenic Nanoflakes, Chem. Mater., 2019, 31(12), 4524-4535.
  9. Jun Zhao, Zheng‐Hang Qi, Yong Xu, Jun Dai, Xiao Cheng Zeng, Wanlin Guo, and Jing Ma*, Theoretical studies on tunable electronic structures and potential applications of two‐dimensional arsenene‐based materials. WIREs Comput. Mol. Sci., 2019, 9(2):e1387.
  10. Wenmin Wang#, Liuzhou Gao#, Haiyan Wei, Zheng-Hang Qi, Guixiang Zeng, Xu Cheng, Guoqiang Wang, Jing Ma*, Selectivity Control of Pd(PMe3)4-Catalyzed Hydrogenation of Internal Alkynes to E-alkenes by Reaction Time and water Content in Formic Acid, Dalton Trans., 2019, 48, 10033-10042.
  11. Yanle Li#, Chunyan Liu#, Zhichen Pu, Linquan Bao, Yan Zhu*, Jing Ma*, Planar versus Nonplanar Pd Clusters: Stability and CO Oxidation Activity of Pd Clusters with and without TiO2(110) Substrate, J. Phys. Chem. C, 2019, 123, 13739-13747.
  12. Chuan-Lei Zhang, Zi-Teng Liu, Heng Xu, He-Gen Zheng*, Jing Ma*, Jing Zhao*, An excellent example illustrating the fluorescence sensing property of cobalt–organic frameworks, Dalton Trans., 2019, 48, 2285.
  13. Harikrishna Sahu, Feng Yang, Xiaobo Ye, Jing Ma, Weihai Fang, Haibo Ma*, Designing promising molecules for organic solar cells via machine learning assisted virtual screening, J. Mater. Chem. A, 2019, 7, 17480-17488.
  14. Wanqing Wei, Jing Ma, Daiqian Xie, Yanzi Zhou*, Linking inhibitor motions to proteolytic stability of sunflower trypsin inhibitor-1, RSC Adv., 2019, 9, 13776.
  15. Jin Huang, Dong Zheng, Bang’an Peng, Menghao Kong, Yixiao Hang, Jing Ma*, Xudong Jia*, Unlocking the action mechanisms of molecular nonlinear optical absorption for optical conjugated polymers under aggregation states, Polym. Chem., 2019, 10, 114.
  16. Dai Zeng#, Xiang-Ai Yuan#, Jing-Cui Liu#, Li Li, Lu-Ping Wang, Ming-Feng Qin, Song-Song Bao, Jing Ma,* and Li-Min Zheng*, Cyclometalated Iridium(III) Complexes Incorporating Aromatic Phosphonate Ligands: Syntheses, Structures, and Tunable Optical Properties, ACS Omega 2019, 4, 16543-16550.
  17. Yaping Chen, Xingyong Wang, Mengmeng Lao, Kun Rui, Xiaobo Zheng, Haibo Yu,*,Jing Ma, Shi Xue Dou, Wenping Sun, Electrocatalytically inactive SnS2 promotes water adsorption/dissociationon molybdenum dichalcogenides for accelerated alkaline hydrogen evolution, Nano Energy, 2019, 64, 103918.
  18. Yanle Li, Chunyan Liu*, Vytor Oliveira, Dieter Cremer, Zijia Chen, Jing Ma*, Odd-even effect of the number of free valence electrons on the electronic structure properties of gold-thiolate clusters, Mol. Phys., 2019, 117, 1442-1450.
  19. Hui Cao*, Shurong Wang, Mingdao Zhang, Tao Tao, Jinwei Sun, Jing Ma*, Simulations on photovoltaic conversionin perovskite solar cells by solving hierarchical equations of motion, AIP Adv., 2019, 9, 055322.
  20. Chuanjun Shu#, Qiang Zhu#, Ke Xiao, Yue Hou, Haibo Ma*, Jing Ma, Xiao Sun*, Direct Extracellular Electron Transfer of the Geobacter sulfurreducens Pili Relevant to Interaromatic Distances, BioMed Res. Int., 2019, 2019, 6151587.
  21. Liuzhou Gao, Guoqiang Wang, Jia Cao, Hui Chen, Yuming Gu, Xueting Liu, Xu Cheng, Jing Ma, Shuhua Li*, Lewis Acid-Catalyzed Selective Reductive Decarboxylative Pyridylation of N-Hydroxyphthalimide Esters: Synthesis of Congested Pyridine-Substituted Quaternary Carbons, ACS Catal. 2019, 9, 10142−10151.
  22. Yuan Chen, Mi Tang, Yanchao Wu, Xiaozhi Su, Xiang Li, Shuaifei Xu, Shuming Zhuo, Jing Ma, Daqiang Yuan, Chengliang Wang,* Wenping Hu, A One-Dimensional π–d Conjugated Coordination Polymer for Sodium Storage with Catalytic Activity in Negishi Coupling, Angew. Chem. Int. Ed. 2019, 58, 14731 – 14739.
  1. Peiming Liu, Lian Sun, Pingying Liu, Wenqian Yu, Qianhui Zhang, Weibing Zhang, Jing Ma, Pingsheng Liu*, Jian Shen*, Surface modification of porous PLGA scaffolds with plasma for preventing dimensional shrinkage and promoting scaffold–cell/tissue interactions. J. Mater. Chem. B, 2018, 6, 7605-7613.
  2. Yanrong Wang, Xiaolan Xue, Pingying Liu, Caixing Wang, Xu Yi, Yi Hu, Lianbo Ma, Guoyin Zhu, Renpeng Chen, Tao Chen, Jing Ma,* Jie Liu, Zhong Jin* Atomic Substitution Enabled Synthesis of Vacancy-Rich Two-Dimensional Black TiO2−x Nanoflakes for High-Performance Rechargeable Magnesium Batteries ACS Nano 2018, 12, 12492−12502.
  3. Bárbara Santos Gomes, Eleonora Cantini, Stefano Tommasone, Joshua S.Gibson, Xingyong Wang, Qiang Zhu, Jing Ma, James D. McGettrick, Trystan M. Watson, Jon A. Preece, Jackson C. Kirkman-Brown, Stephen J. Publicover, and Paula M. Mendes. On-Demand Electrical Switching of Antibody−Antigen Binding on Surface. ACS Appl. Bio Mater. 2018, 1, 738−747.
  4. Jing-Jing Lv#, Yanle Li#, Shaojun Wu, Hua Fang, Ling-Ling Li, Rong-Bin Song, Jing Ma*, and Jun-Jie Zhu*, Oxygen Species on Nitrogen-Doped Carbon Nanosheets as Efficient Active Sites for Multiple Electrocatalysis. ACS Appl. Mater. Interfaces 2018, 10, 11678−11688.
  5. Dong Zheng, Xiang-Ai Yuan, Haibo Ma, Xiaoxiong Li, Xizhang Wang, Ziteng Liu and Jing Ma*, Unexpected solvent effects on the UV/Vis absorption spectra of o-cresol in toluene and benzene: in contrast with non-aromatic solvents. R. Soc. Open Sci. 2018, 5, 171928.
  6. Lan Sheng,* Qiaonan Chen, Chunyu Wang, Hongwei Chen, Ting Zhang, Tianyou Qin, Minjie Li, Jinyan Zhang, Jing Ma,* and Sean Xiao-An Zhang*, Oxazolidine Transient Bases as Molecular Platforms for Testing Dynamic CO2 Capture in Biochemical Systems. ACS Omega 2018, 3, 2883–2894. Learn More
  7. Xiang-Ai Yuan#, Meng-Na Yu#, Qiang Zhu, Wan-Wan Zhang, Ling-Hai Xie,* Wei Huang and Jing Ma*, Synergistic steric pairing effects of terfluorenes with ternary side groups on β-conformation transition: experiments and computations. J. Mater. Chem. C 2018, 6, 1551‒1561.
  8. Xingyong Wang, Lirong Yu, V. S. Sandeep Inakollu, Xiaobo Pan,* Jing Ma,* and Haibo Yu*, Molecular Quantum Dot Cellular Automata Based on Diboryl Monoradical Anions. J. Phys. Chem. C 2018, 122, 2454–2460.
  9. Zheng-Hang Qi and Jing Ma*, Dual Role of a Photocatalyst: Generation of Ni(0) Catalyst and Promotion of Catalytic C–N Bond Formation. ACS Catal. 2018, 8, 1456−1463.
  10. Xiaowen Yu, Jun Zhao, Li-Rong Zheng, Yue Tong, Miao Zhang, Guochuang Xu, Chun Li, Jing Ma,* and Gaoquan Shi*, Hydrogen Evolution Reaction in Alkaline Media: Alpha- or Beta-Nickel Hydroxide on the Surface of Platinum? ACS Energy Lett. 2018, 3, 237–244.
  11. Yanrong Wang, Ziteng Liu, Caixing Wang, Xu Yi, Renpeng Chen, Lianbo Ma, Yi Hu, Guoyin Zhu, Tao Chen, Zuoxiu Tie, Jing Ma,* Jie Liu, and Zhong Jin*, Highly Branched VS4 Nanodendrites with 1D Atomic‐Chain Structure as a Promising Cathode Material for Long‐Cycling Magnesium Batteries. Adv. Mater. 2018, 30, 1802563.Learn more
  12. Chaoyue Zheng, Tong Tong, Yueming Hu, Yuming Gu, Huarui Wu, Dequn Wu, Hong Meng, Mingdong Yi,* Jing Ma,* Deqing Gao,* and Wei Huang*, Charge‐Storage Aromatic Amino Compounds for Nonvolatile Organic Transistor Memory Devices. Small 2018, 14, 1800756.
  13. Li-Juan Han, Dong Zheng, Shu-Guang Chen, He-Gen Zheng,* and Jing Ma*, A Highly Solvent-Stable Metal-Organic Framework Nanosheet: Morphology Control, Exfoliation, and Luminescent Property. Small 2018, 14, 1703873.
  14. Bingnan Du#, Wenmin Wang#, Yang Wang, Zhenghang Qi, Jiaqi Tian, Jie Zhou, Xiaochen Wang, Jianlin Han,* Jing Ma,* and Yi Pan, Copper‐Catalyzed Oxidative Reaction of β‐Keto Sulfones with Alcohols via C−S Bond Cleavage: Reaction Development and Mechanism Study. Chem. - Asian J. 2018, 13, 404–408.
  15. Xiang-Ai Yuan#, Jin Wen#, Dong Zheng, and Jing Ma*, Simulations of absorption spectra of conjugated oligomers: role of planar conformation and aggregation in condensed phase. Mol. Phys. 2018, 116, 910‒926.
  16. Dongdong Qian,* Lei Zhang, Ying Zhang, Pingying Liu, Xizhang Wang and Jing Ma, Impact of thermal shock cycles on mechanical properties and microstructure of lithium disilicate dental glass-ceramic. Ceram. Int. 2018, 44, 1589–1593.
  17. Chuanlei Zhang, Yanle Li, Heng Xu, Jing Ma, and Hegen Zheng*, The Mutation in the Single‐Crystal Structural Transformation Process, Induced by the Combined Stimuli of Temperature and Solvent. Chem. - Eur. J. 2018, 24, 327–331.
  18. Wenjun Zhang, Yi Hu, Lianbo Ma, Guoyin Zhu, Peiyang Zhao, Xiaolan Xue, Renpeng Chen, Songyuan Yang, Jing Ma, Jie Liu, and Zhong Jin,* Liquid-phase exfoliated ultrathin Bi nanosheets: Uncovering the origins of enhanced electrocatalytic CO2 reduction on two-dimensional metal nanostructure. Nano Energy 2018, 53, 808‒816.
  19. Xiaolan Xue#, Renpeng Chen#, Hongwei Chen#, Yi Hu, Qingqing Ding, Ziteng Liu, Lianbo Ma, Guoyin Zhu, Wenjun Zhang, Qian Yu, Jie Liu, Jing Ma, and Zhong Jin*, Oxygen Vacancy Engineering Promoted Photocatalytic Ammonia Synthesis on Ultrathin Two-Dimensional Bismuth Oxybromide Nanosheets. Nano Lett. 2018, 11, 7372-7377.Learn more
  20. Zhong-Yan Cao#, Wenmin Wang#, Kui Liao, Xiaoming Wang, Jian Zhou* and Jing Ma* Catalytic enantioselective synthesis of cyclopropanes featuring vicinal all-carbon quaternary stereocenters with a CH2F group; study of influence of C-F···H-N interactions on reactivity, Org. Chem. Front., 2018, 5, 2960-2968.
  21. Yuxin Qian, Yuming Gu, Jiajing Feng, Wei Jiang, Yanfang Geng, Wubiao Duan,* Jing Ma,* Qingdao Zeng,* and Zhaohui Wang, Role of Synergistic C−H···N and C−H···O H Bonding Interactions in Self-Assemblies of a Phthalocyanine Derivative and Several Pyridine Derivatives, J. Phys. Chem. C 2018, 122, 24158−24163.
  22. Mi Tang, Shaolong Zhu, Ziteng Liu, Cheng Jiang, Yanchao Wu, Hongyang Li, Bo Wang, Erjing Wang, Jing Ma, and Chengliang Wang*, Tailoring π-Conjugated Systems: From π-π Stacking to High-Rate-Performance Organic Cathodes. Chem 2018, 4, 2600–2614.
  23. Pingying Liu, Chunyan Liu, Qian Liu, Jing Ma*, Influence of Photoisomerization on Binding Energy and Conformation of Azobenzene-Containing Host-Guest Complex, Acta Phys. -Chim. Sin. 2018, 34, 1171–1178.
  1. Sun Xiaoyang, Wang Wenmin, Ma Jing*, Yu Shouyun*, Halogen-Bond-Promoted Radical Isocyanide Insertion of o-Diisocyanoarenes with Perfluoroalkyl Bromides under Visible Light Irradiation, Acta Chim. Sinica 2017, 75, 115—118.
  2. Bingnan Du, Wenmin Wang, Yang Wang, Zhenghang Qi, Jiaqi Tian, Jie Zhou, Xiaochen Wang, Jianlin Han,* Jing Ma,* and Yi Pan Copper-Catalyzed Oxidative Reaction of β-Keto Sulfones with Alcohols via C−S Bond Cleavage: Reaction Development and Mechanism Study, Chem. Asian J. 10.1002/asia.201701694.
  3. Zigui Kan, Qiang Zhu, Lijiang Yang*, Zhixiong Huang, Biaobing Jin, and Jing Ma*, Polarization effects on the cellulose dissolution in ionic liquids: Molecular dynamics simulations with polarization model and integrated tempering enhanced sampling method, J. Phys. Chem. B, 2017, 121, 4319–4332.
  4. Zigui Kan, Dong Zheng, Jing Ma*, Self-aggregation of trehalose in the mixed solvents of 1,3-dimethylimidazolium ionic liquid and water, Mol. Simulat., 2017, 43, 1160-1171.
  5. Qiang Zhu, Yilin Lu, Xibing He, Tao Liu, Hongwei Chen, Fang Wang, Dong Zheng, Hao Dong*, Jing Ma,* Entropy and Polarity Control the Partition and Transportation of Drug-like Molecules in Biological Membrane, Scientific Reports, 2017, 7, 17749. DOI: 10.1038/s41598-017-18012-7
  6. Jun Zhao, Chunyan Liu and Jing Ma*, A Light-Driven Modulation of Electric Conductance through the Adsorption of Azobenzene onto Silicon-Doped and Pyridine-Like N3-Vacancy Graphene, Nanoscale, 2017, 9, 19017-19025. DOI: 10.1039/C7NR07382H
  7. Wenmin Wang#, Xiaoyang Sun#, Jian Qu, Xiaoyu Xie, Zheng-Hang Qi, Daocheng Hong, Su Jing, Dong Zheng, Yuxi Tian, Haibo Ma, Shouyun Yu*, Jing Ma*, Aggregation-Induced Visible Light Absorption Makes Reactant 1,2-Diisocyanoarenes Act as Photosensitizer in Double Radical Isocyanide Insertions. Phys. Chem. Chem. Phys., 2017, 19,31443-31451. DOI: 10.1039/C7CP05936A
  8. Chunyan Liu, Dong Zheng, Weigang Hu, Qiang Zhu, Ziqi Tian, Jun Zhao, Yan Zhu* Jing Ma*, Tuning the collective switching behavior of azobenzene/Au hybrid materials: flexible versus rigid azobenzene backbone and Au(111) surface versus curved Au nanoparticle. Nanoscale, 2017, 9, 16700-16710.
  9. Yanle Li#, Vytor Olivera#, Chunmei Tang, Dieter Cremer*, Chunyan Liu, Jing Ma*, The Peculiar Role of the Au3 Unit in Aum Clusters: σ-Aromaticity of the Au5Zn+ Ion. Inorg. Chem., 2017, 56, 5793-5803.
  10. Weizhi Li, Xiangai Yuan, Jin Huang, Feng Zhou, Jing Ma, and Xudong Jia*, Synthesis of heat-resistant benzoxazine-based polyfluorene and its reversible temperature-sensitive fluorescence. Polymer, 2017, 109, 126-136.
  11. Wenqiang Li, Qian Peng*, Huili Ma, Jin Wen, Jing Ma, Linda A. Peteanu, and Zhigang Shuai*, Theoretical Investigations on the Roles of Intramolecular Structure Distortion versus Irregular Intermolecular Packing in Optical Spectra of 6T Nanoparticles, Chem. Mater., 2017, 29, 2513-2520. DOI: 10.1021/acs.chemmater.6b04210.
  12. Jingjing Lv, Jun Zhao, Hua Fang, Liping Jiang, Jing Ma*, Junjie Zhu*. Incorporating Nitrogen-Doped Graphene Quantum Dots and Ni3S2Nanosheets: A Synergistic Electrocatalyst with Highly Enhanced Activity for Overall Water Splitting.Small, 2017, 13, 1700264. DOI: 10.1002/smll.201700264.
  13. Jun Zhao, Wanlin Guo, Jing Ma*, Prediction on the Light-Assisted Exfoliation of Multilayered Arsenene, Nanoscale, 2017, 9, 7006-7011.
  14. Jun Zhao, Wanlin Guo, Jing Ma* Tunable Rashba spin splitting in quantum-spin Hall-insulator AsF bilayers. Nano Research, 2017, 10, 491-502. DOI: 10.1007/s12274-016-1308-2.
  1. Xiangai Yuan, Dong Zheng, Xizhang Wang, Pingying Liu, Jing Ma. Unconventional O−H···C Hydrogen Bonding and Effects of Conformational Changes on Infrared Spectroscopy of o‑Cresol in Solutions. J. Phys. Chem. A 2016, 120, 10196−10206.
  2. Xiaoyang Sun, Wenmin Wang, Yanle Li, Jing Ma,* and Shouyun Yu* Halogen-Bond-Promoted Double Radical Isocyanide Insertion under Visible-Light Irradiation: Synthesis of 2-Fluoroalkylated Quinoxalines, Org. Lett. 2016, 18, 4638−4641
  3. Dan Wang, Shanqing Huang, Pingying Liu, Xichun Liu, Yafeng He, Weizhong Chen, Qingyuan Hu, TianbiaoWei, JianhuaGan, Jing Ma*, Hao Chen*, Structural Analysis of the Hg(II)-Regulatory Protein Tn501 MerR from Pseudomonas aeruginosa. Scientific Reports. 2016, 6, 33391. DOI: 10.1038/srep33391.
  4. Pingying Liu, Qiufeng Chen, Jing Ma*, Design of [2]rotaxane through image threshold segmentation of electrostatic potential image. Journal of Computational Chemistry 2016, 37, 2228-2241.
  5. Jun Zhao, Jing Ma. Theoretical Designs of Photoresponsive Energy-Storage Materials Based on Attachment of π-Conjugated Molecules onto Sulfur-Doped Graphene. J. Phys. Chem. C, 2016, 120, 25131-25141.
  6. Jun Zhao, Wanlin Guo, Jing Ma. Tunable Rashba spin splitting in quantum-spin Hall-insulator AsF bilayers. Nano. Res. 2016, DOI: 10.1007/s12274-016-1308-2.
  7. Wenxin Chen, Zheng Liu, Jiaqi Tian, Jin Li, Jing Ma*, Xu Cheng*, Guigen Li, Building Congested Ketone: Substituted Hantzsch Ester and Nitrile as Alkylation Reagent in Photoredox Catalysis J. Am. Chem. Soc. 2016, 138, 12312-12315. DOI: 10.1021/jacs.6b06379.
  8. Yufei Jiang, Lijun Yang,* Xizhang Wang, Qiang Wu, Jing Ma and Zheng Hu*, Doping sp2 carbon to boost the activity for oxygen reduction in an acidic medium: a theoretical exploration, RSC Adv., 2016, 6, 48498-48503.
  9. Eleonora Cantini, Xingyong Wang, Patrick Koelsch, Jon Preece, Jing Ma,* Paula M. Mendes*, Electrically-responsive surfaces: Experimental and theoretical investigations, Acc. Chem. Res., 2016, 49, 1223-1231.
  10. Jin Wen, Wei Li, ShuangChen and Jing Ma*, Simulations of Molecular Self-Assembled Monolayers on Surfaces: Packing Structures, Formation Process and Functions Tuned by Intermolecular and Interfacial Interactions, Phys. Chem. Chem. Phys. 2016, 18, 22757-22771. DOI:10.1039/c6cp01049k.
  11. Jun Zhao, Yanle Li, Jing Ma*, Quantum spin Hall insulators in functionalized arsenene (AsX, X = F, OH and CH3) monolayers with pronounced light absorption, NANOSCALE, 2016, 8, 9657-9666.
  12. Xiangai Yuan, Wenmin Wang,Ziqi Tian, Siwei Bi*, Jing Ma*, Electron-donating groups and high ring strain promoted ring opening of methylenecyclopropanes catalyzed by rhodium and iridium complexes, J. Organometallic Chem. 2016, 811, 29-39.
  13. Guoyong Fang,* Lina Xu, Jing Ma, and Aidong Li, Theoretical Understanding of the Reaction Mechanism of SiO2 Atomic Layer Deposition, Chem. Mater. 2016, 28, 1247-1255.
  14. Zheng Dong, Yuan Xiang-Ai, Ma Jing*, Rationalization of pH -Dependent Absorption Spectrum of o-Methyl Red in Aqueous Solutions: TD-DFT Calculation and Experiment Study ACTA PHYSICO-CHIMICA SINICA, 2016, 32, 290-300.
  15. Pingying Liu, Qiufeng Cheng, Jing Ma*, Evaluation of binding strength for supramolecules through image threshold segmentation, Scientia Sinica Chimica 2016, 46, 69-79. (柳平英; 陈秋凤; 马晶*, 运用静电势图像分割方法预测超分子结合能中国科学. 化学, 2016, 46, 69-79.)
  16. Jian Qu, Yinlin Song, Wei Ji, Su Jing,* Dunru Zhu,* Wei Huang*, Mengxi Zheng, Yanle Li, Jing Ma, Macrocyclic Se4N2[7,7]ferrocenophane and Se2N[10]ferrocenophane containing benzyl unit: synthesis, complexation, crystal structures, electrochemical and optical properties, Dalton Trans., 2016, 45, 3417-3428.
  17. Pingying Liu, Wei Li*, Zigui Kan, Hui Sun, and Jing Ma*, Factor Analysis of Conformations and NMR Signals of Rotaxanes: AIMD and Polarizable MD Simulations, J. Phys. Chem. A, 2016, 120, 490–502. DOI: 10.1021/acs.jpca.5b10085
  1. Chunyan Liu, Yong Pei*, Hui Sun, Jing Ma*, The nucleation and growth mechanism of thiolate-protected Au nanoclusters, J. Am. Chem. Soc. 2015, 137, 15809-15816. DOI: 10.1021/jacs.5b09466.
  2. Jun Zhao, Xingyong Wang, Nan Jiang, Tianying Yan, Zigui Kan, Paula M. Mendes, and Jing Ma* Polarization Effect and Electric Potential Changes in the Stimuli-Responsive Molecular Monolayers Under an External Electric Field, J. Phys. Chem. C, 2015, 119, 22866–22881. DOI: 10.1021/acs.jpcc.5b04805.
  3. Yufei Jiang, Lijun Yang,* Tao Sun, Jin Zhao, Zhiyang Lyu, Ou Zhuo, Xizhang Wang, Qiang Wu, Jing Ma, and Zheng Hu* Significant Contribution of Intrinsic Carbon Defects to Oxygen Reduction Activity, ACS Catalysis, 2015, 5, 6707-6712.
  4. Juan Pang, Ziqi Tian, Jing Ma,* Theoretical Design and Computational Simualtions of Visible Light Driven Azobenzene-based Switches. Scientia Sinica Chimica 2015, 45(4): 412–418 (in Chinese). [庞娟, 田子奇, 马晶*，可见光驱动的偶氮苯分子开关的理论设计与计算模拟，中国科学:化学, 2015, 45(4): -418
  5. Maozhong Miao, Wenmin Wang,Weijun Yang, Lijun Xu, Jing Ma,* and Hongjun Ren.* Spontaneous Dimerization of Allenes in Situ: An Efficient Synthesis of Substituted 1,2-Dimethylenecyclobutanes with High Regio- and Stereoselectivities. Chem.-Eur. J., 2015, 21, 14447.
  6. Xiangai Yuan, Wanwan Zhang, Ling-Hai Xie*, Jing Ma*, Wei Huang, and Wenjian Liu*. Role of Planar Conformations in Aggregation Induced Spectral Shifts of Supermolecular Oligofluorenols in Solutions and Films: A Combined Experimental and MD/TD-DFT Study J. Phys. Chem. B, 2015, 119, 10316
  7. Yuanzheng Cheng, Xiangai Yuan, Jing Ma,* and Shouyun Yu,* Direct Aromatic C-H Trifluoromethylation via Electron-Donor-Acceptor Complex. Chem.-Eur. J., 2015, 21, 8355.
  8. Chuan-Lei Zhang, Yan-Le Li, Ting Wang, Ze-Min Ju, He-Gen Zheng* and Jing Ma,* Three different metal-organic frameworks derived from a one-pot crystallization and their controllable synthesis. Chem. Commun., 2015, 51, 8338.
  9. Xingyong Wang, Tianying Yan,* and Jing Ma,* Polarizable Force Fields Based on Physical Models and Quantum Chemical Calculations. Int. J. Quantum Chem., 2015, 115, 545.
  10. Shuo Chen, Yoshimitsu Itoh,* Takuya Masuda, Seishi Shimizu, Jun Zhao, Jing Ma, Shugo Nakamura, Kou Okuro, Hidenori Noguchi, Kohei Uosaki, Takuzo Aida,* Subnonoscale hydrophobic modulation of salt bridges in aqueous media. Science, 2015, 348, 555.
  11. Zigui Kan, Xiufen Yan, Jing Ma,* Conformation Dynamics and Polarization Effect of α,α-Trehalose in a Vacuum and in Aqueous and Salt Solutions. J. Phys. Chem. A, 2015, 119, 1573.
  12. Ziqi Tian, Jin Wen, Jing Ma.* Dynamic Simulations of Stimuli-Responsive Switching of Azobenzene Derivatives in Self-assembled Monolayers: Reactive Rotation Potential and Switching Functions. Molecular Simulation, 2015, 41(vol), 28.DOI: 10.1080/08927022 (review).
  1. Jiyun Hong, SuKyung Jeon, Janice J. Kim, Diane Devi, Kelly Chacon-Madrid, Wynee Lee, Seung Moh Koo, Jurjen Wildeman, Matthew Y. Sfeir,§ and Linda A. Peteanu*,Jin Wen and Jing Ma* The effects of Side-Chain-Induced Disorder on the Emission Spectra and Quantum Yields of Oligothiophene Nanoaggregates: A Combined Experimental and MD-TDDFT Study. J. Phys. Chem. A, 2014, 118, 10464.
  2. Juan Pang, Ziqi Tian, Jing Ma,* Theoretical design of visible light driven azobenzene-based photoswitching molecules. Chem. Phys. Lett., 2014, 613(vol), 110.
  3. Pingying Liu, Wei Li, Li Liu, Leyong Wang, Jing Ma,* Theoretical Study on Conformation Dynamics of Three-Station Molecular Shuttle in Different Environments and its Influence on NMR Chemical Shifts and Binding Interactions. J. Phys. Chem. A, 2014, 118, 9032.
  4. Zheyu Liu, Jing Ma,* Facile interconversions of topology and aromaticity of expanded porphyrin in solution. Sci. China Chem., 2014, 10, 1369.
  5. Ming-Dao Zhang, Zi-Yang Zhang, Zhong-Qiu Bao, Ze-Min Ju, Xing-Yong Wang, He-Gen Zheng,* Jing Ma* and Xing-Fu Zhou, Promising alkoxy-wrapped porphyrins with novel push-pull moieties for dye-sensitized solar cells. J. Mater. Chem. A, 2014, 36, 14883.
  6. Yuanzheng Cheng, Xiangai Yuan, Heng Jiang, Ruzhi Wang, Jing Ma,* Yan Zhang,* and Shouyun Yua,* Regiospecific Synthesis of 1-Trifluoromethylisoquinolines Enabled by Photoredox Somophilic Vinyl Isocyanide Insertion. Adv. Synth. Catal., 2014, 13, 2859.
  7. Jingwen Zhao , Jiale Chen , Simin Xu , Mingfei Shao , Qiang Zhang , Fei Wei , Jing Ma ,Min Wei , * David G. Evans , and Xue Duan, Hierarchical NiMn Layered Double Hydroxide/Carbon Nanotubes Architecture with Superb Energy Density for Flexible Supercapacitors. Adv. Funct. Mater., 2014, 24, 2938.
  8. Yi Li, Shuang Chen, Qi Liu, Yun Li, Yi Shi, Xizhang Wang,*, Jing Ma,*, and Zheng Hu, Influence of Deposition Pressure on the Film Morphologies, Structures, and Mobilities for Different-Shaped Organic Semiconductors J. Phys. Chem. C 2014, 26, 14218.10.1021/jp5035954
  9. Shuhua Li*, Wei Li, and Jing Ma, "Generalized Energy-Based Fragmentation Approach and Its Applications to Macromolecules and Molecular Aggregates." Acc. Chem. Res. 2014, 47, 2712. DOI: 10.1021/ar500038z
  10. Qi Liu, Yi Li, Xingyong Wang, Wei Huang, Jing Ma, Yun Li,* Yi Shi, Xizhang Wang*,Zheng Hu, Enhancing charge transport in copper phthalocyanine thin film by elevating pressure of deposition chamber, Organic Electronics, 2014, 15, 1799-1804.
  11. Jin Xie, Xiangai Yuan, Ablimit Abdukader, Pan Xu, Chengjian Zhu,* Jing Ma,* Visible-Light-Promoted Radical C-H Trifluoromethylation of Free Anilines, Org. Lett. 2014, 16, 1768.
  12. Yangfan Guan, Pingying Liu, Chao Deng, Mengfei Ni, Shuhan Xiong, Chen Lin, Xiaoyu Hu*, Jing Ma*, Leyong Wang*, Org. Biomol. Chem. 2014, 12, 1079.
  13. Xiaoyu Chen, Xingyong Wang, Yunxia Sui, Yizhi Li, Jing Ma,* Jinglin Zuo, and Xinping Wang,* Reply to Comments on "Synthesis, Characterization, and Structures of Persistent Aniline Radical Cation". Angew. Chem., Int. Ed. 2014, 53, 943.
  14. Chun L. Yeung, Xingyong Wang, Minhaj Lashkor, Eleonora Cantini, Frankie J. Rawson, Parvez Iqbal, Jon A. Preece, Jing Ma,* Paula M. Mendes,* Modulation of bioactivity by electrically switchable oligopeptide surfaces: structural requirements and mechanism. Adv. Mater. Interface. 2014, 1, 1300085.
  15. Parvez Iqbal, Watson Kwok-Wai Ho, Siu-Fung Lee, Ken Cham-Fai Leung, Xingyong Wang, Akash Beri, Jon A. Preece, Jing Ma, Paula M. Mendes,* Surface Molecular Tailoring using pH-Switchable Supramolecular Dendron-Ligand Assemblies, ACS Appl. Mater. Interfaces, 2014, 6, 6264.
  16. Li-Ming Yang,* Guo-Yong Fang, Jing Ma, Eric Ganz, and Sang Soo Han, Band Gap Engineering of Paradigm MOF-5, Cryst. Growth Des. 2014, 14, 2532-2541. DOI:10.1021/cg500243s
  17. Ziqi Tian, Yuanjing Xiao, Xiangai Yuan, Zuliang Chen, Junliang Zhang,* Jing Ma*. Control chemoselectivity by coordinated water and relative size of ligands to metal cations of Lewis acid catalysts for cycloaddition of oxirane derivative with aldehyde: Theoretical and experimental study. Organometallics, 2014, 33, 1715.
  1. T. Zheng, J. M. Clemente-Juan, J. Ma, L. Dong, S.-S. Bao, Jian Huang, Eugenio Coronado, Li-Min Zheng,* Breathing Effect in a Cobalt Phosphonate upon Dehydration/rehydration: A Single–crystal to Single–crystal Study, Chem. Eur. J. 2013, 19, 19, 16394 – 16402.
  2. Guoyong Fang, Jing Ma,* Rapid atomic layer deposition of silica nanolaminates: synergistic catalysis of Lewis/Br?nsted acid sites and interfacial interactions, Nanoscale, 2013, 5, 23, 11856.
  3. Xin Zheng, Xingyong Wang,Yunfan Qiu,Yuantao Li, Chenkun Zhou,Yunxia Sui, Yizhi Li, Jing Ma, and Xinping Wang*. One-Electron Oxidation of an Organic Molecule by B(C6F5)(3); Isolation and Structures of Stable Non-para-substituted Triarylamine Cation Radical and Bis(triarylamine) Dication Diradicaloid. J. Am. Chem. Soc., 2013, 135, 14912-14915. DOI: 10.1021/ja407318h
  4. Jin Wen; Ziqi Tian; Jing Ma*. Light- and Electric-Field-Induced Switching of Thiolated Azobenzene Self-Assembled Monolayer. J. Phys. Chem. C 2013, 117, 19934-19944. DOI: 10.1021/jp404434r.
  5. WenJian Liu*; Jing Ma. Theoretical study of low-lying excited states of molecular aggregates. I. Development of linear-scaling TD-DFT. Sci. China. Chem. 2013, 56, 1263-1266. DOI: 10.1007/s11426-013-4908-7.
  6. Ziqi Tian; Jin Wen; Jing Ma*. Reactive molecular dynamics simulations of switching processes of azobenzene-based monolayer on surface. J. Chem. Phys. 2013, 139, 014706. DOI: 10.1063/1.4812379
  7. Wei Ji, Su Jing,* Zeyu Liu, Jing Shen, Jing Ma,* Dunru Zhu,* Dengke Cao, Limin Zheng,and Minxia Yao.Synthesis and Study of Three Novel Macrocyclic Selena[n]ferrocenophanes Containing a Naphthalene Unit. Inorg. Chem. 2013,52, 5786-5793. DOI: 10.1021/ic302628y.
  8. Xingyong Wang, Shuang Chen, Jin Wen, and Jing Ma*. Exploring the Possibility of Noncovalently Surface Bound Molecular Quantum-Dot Cellular Automata: Theoretical Simulations of Deposition of Double-Cage Fluorinated Fullerenes on Ag(100) Surface. J. Phys. Chem. C, 2013, 117, 1308-1314. DOI: 10.1021/jp306903w. (Cover Art)
  9. Jia-ming Wang , Nan Jiang , Jing Ma,* Shi-shan Yu*, Ren-xiang Tan , Jun-gui Dai, Yi-kang Si. Guang-zhi Ding , Shuang-gang Ma, Jing Qu, Lei Fang , Dan Du. Study on absolute configurations of alpha/alpha ' chiral carbons of thiodiketopiperazines by experimental and calculated circular dichroism spectra. Tetrahedron. 2013, 69, 1195-1201.
  10. Liu, Li; Liu, Yuanyuan; Liu, Pingying; JieWu, Yangfan Guan, Xiaoyu Hu, Chen Lin,Yang Yang, Xiaoqiang Sun, Jing Ma and Leyong Wang*. Phosphine oxide functional group based three-station molecular shuttle. Chem. Sci, 2013,4, 1701-1706.
  11. Xiaoyu Chen, Binbin Ma, Shuang Chen, Yizhi Li, Wei Huang, Jing Ma, and Xinping Wang*, Synthesis, Crystal Structure, and Physical Property of Sterically Unprotected Thiophene/Phenylene Co-Oligomer Radical Cations: A Conductive pi-pi Bonded Supermolecular meso-Helix. Chem.Asian. 2013, 8, 238-243.
  12. Xiaoyu Chen, Xingyong Wang, Zhaoyi Zhou, Yizhi Li, Yunxia Sui, Jing Ma, Xinping Wang,* and Philip P. Power,* Reversible σ-dimerizations of persistent organic radical cations. Angew. Chem. Int. Ed. 2013, 52, 589-592.
  1. Jian Huang, Ping-Ying Liu, Hui Zhu, Song-Song Bao, Li-Min Zheng,* and Jing Ma*, Supramolecular Isomerism of One-Dimensional Copper(II) Phosphonate and Its Influence on the Magnetic Properties. ChemPlusChem. 2012, 77, 1087-1095.
  2. Meng Su-Ci; Yin Xiu-Lian; Ma Jing; Ji-Min Xie. Theoretical Studies on Solvent Effects and Intermolecular Interactions of Organic pi-Conjugated Ligand in Solutions CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-HINESE. 2012, 33, 2492-2500.
  3. Guoyong Fang, Shuang Chen, Aidong Li, and Jing Ma* Surface Pseudorotation in Lewis-Base-Catalyzed Atomic Layer Deposition of SiO2: Static Transition State Search and Born-Oppenheimer Molecular Dynamics Simulation, J. Phys. Chem. C, 2012,116, 26436-26448.
  4. Zuliang Chen, Ziqi Tian, Jieming Zhang, Jing Ma,* and Junliang Zhang* C-O Versus C-C Bond Cleavage: Selectivity Control in Lewis Acid Catalyzed Chemodivergent Cycloadditions of Aryl Oxiranyldicarboxylates with Aldehydes, and Theoretical Rationalizations of Reaction Pathways Chem. Eur. J. 2012, 18, 8591- 8595 .
  5. Shuang Chen and Jing Ma*. Substituent effects on packing entropy and film morphologies in the nucleation of functionalized pentacenes on SiO2 substrate: Molecular dynamics simulations. J. Chem. Phys. 2012, 137, 074708.
  6. Xiaoyu Chen, Xingyong Wang, Yunxia Sui, Yizhi Li, Jing Ma,* Jinglin Zuo, and Xinping Wang* Synthesis,characterization, and structures of a persistent aniline radical cation. Angew. Chem. Int. Ed. 2012, 51, 11878-11881.
  7. Xiaoyu Chen, Binbin Ma, Xingyong Wang, Shengxin Yao, Lichen Ni, Zhaoyi Zhou, Yizhi Li, Wei Huang, Jing Ma, Jinglin Zuo,* and Xinping Wang*. From Monomers to p Stacks, from Nonconductive to Conductive: Syntheses, Characterization, and Crystal Structures of Benzidine Radical Cations. Chem. Eur. J. 2012, 18, 11828-11836.
  8. Zeyu Liu, Ziqi Tian, Wenbin Li, Suci Meng, Leyong Wang, and Jing Ma*. Chiral Interconversions of Pd and/or Au Bis-Metalated [32]Octaphyrins(1,0,1,0,1,0,1,0) Involving Hückel and M?bius Macrocyclic Topologies: A Theoretical Prediction.J. Org. Chem., 2012, 77, 8124-8130.
  9. Jean-Paul Malrieu, Hongjiang Zhang, Jing Ma,Is the dynamical polarization a significant part of the contribution of the triples to the correlation energy? Theor. Chem. Acc. 2012, 131,1156.
  10. Guo-Jun Kang, Jing Ma, Zhao-Xu Chen,Theoretical Studies of Species Related to Acrolein Hydrogenation,Catal. Lett. 2012, 142, 287-293.
  11. Suci Meng and Jing Ma*,Solvent Effects on Isomerization and Spectral Properties of Photochromic-Switching Diarythene Derivatives in Polar and Apolar Solutions, J. Phys. Chem. A 2012, 116, 913-923.
  12. Jin Wen and Jing Ma*,Modulating Morphology of Thiol-Based Monolayers in Honeycomb Hydrogen-Bonded Nanoporous Templates on the Au(111) Surface: Simulations with the Modified Force Field, J. Phys. Chem. C 2012, 116, 8523-8534.
  13. Yi Li, Shuang Chen, Qi Liu, Leyong Wang, Takao Someya, Jing Ma, Xizhang Wang*, and Zheng Hu,Deposition-pressure-induced optimization of molecular packing for high performance organic thin film transistors based on copper phthalocyanine,J. Phys. Chem. C 2012, 116, 4287-4292.
  14. Nan Jiang and Jing Ma*,Multi-layer coarse-graining polarization model for treating electrostatic interactions of solvated 伪-conotoxin peptidesJ. Chem. Phys. 2012, 136, 134105.
  15. Hongjiang Zhang, Jean-Paul Malrieu, Haibo Ma and Jing Ma*, Implementation of renormalized excitonic method at ab initio level.J.Comput.Chem.2012,33,34-43.DOI: 10.1002/jcc.21941.
  16. Shin A. Moteki, Kazuya Toyama, Zeyu Liu, Jing Ma, Andrea E. Holmes and James M. Takacs*,Two-stage optimization of a supramolecular catalyst for catalytic asymmetric hydroboration.Chem. Commun. 2012, 48, 263-265. DOI: 10.1039/c1cc16146f.
  1. Xian-Fu Wu, Ya-Dan Wang, Shi-Shan Yu, Nan Jiang, Jing Ma, Ren-Xiang Tan, You-Cai Hu, Jing Qu Antioxidative acylphloroglucinols from the roots of Lysidice rhodostegia.TETRAHEDRON2011, 67, 8155-8159. DOI: 10.1016/j.tet.2011.08.034.
  2. Yong Wang, Guoyong Fang, Jing Ma, Yuansheng Jiang, Facial dissociations of water molecules on the outside and inside of armchair single-walled silicon nanotubes: theoretical predictions from multilayer quantum chemical calculations. Theor. Chem. Acc.2011, 130, 463-473. DOI: 10.1007/s00214-011-1024-7.
  3. Shuang Chen, Guoyong Fang, Xu Qian, Aidong Li, and Jing Ma*, Influence of Alkalinity and Steric Hindrance of Lewis-Base Catalysts on Atomic Layer Deposition of SiO2 J. Phys. Chem. C, 2011, 115, 23363-23373. DOI: 10.1021/jp2048663
  4. Guoxing Zhu, Shuguang Zhang, Zheng Xu*, Jing Ma*, and Xiaoping Shen, Ultrathin ZnS Single Crystal Nanowires: Controlled Synthesis and Room-Temperature Ferromagnetism Properties.J. Am. Chem. Soc., 2011, 133, 15605-15612
  5. Zeyu Liu and Jing Ma*, Effects of External Electric Field and Self-Aggregations on Conformational Transition and Optical Properties of Azobenzene-Based D-π-A Type Chromophore in THF Solution. J. Phys. Chem. A, 2011, 115, 10136-10145. (COVER ART)
  6. Nan Jiang and Jing Ma*,Can a Proton be Encapsulated in Tetraamido/Diamino Quaternized Macrocycles in Aqueous Solution and Electric Field? ChemPhysChem, 2011, 12, 2452-2459
  7. Haibo Ma* and Jing Ma, Density dependence of hydrogen bonding and the translational-orientational structural order in supercritical water: A molecular dynamics study.J. Chem. Phys., 2011, 135, 054504/1-8
  8. Dongpeng Yan, Jun Lu, Jing Ma, Min Wei, David G. Evans, and Xue Duan. Fabrication of an Anionic Polythiophene/Layered Double Hydroxide Ultrathin Film Showing Red Luminescence and Reversible pH Photoresponse. AIChE Journal, 2011, 57, 1926-1935
  9. Juan Pang, Hu Yang*, Jing Ma*, Rongshi Cheng. Understanding Different Lcst Levels of Poly(N-Alkylacrylamide)S By Molecular Dynamics Simulations and Quantum Mechanics Calculations.J. Theor. Comput. Chem., 2011, 10, 359-370
  10. Li Liu, Zhiqiang Zhou, Jieping Shi, Zeyu Liu, Changgui Lu, Weijiang He, Jing Ma, Yiping Cui*, Guo-Yuan Lu*. Photophysical and two-photon absorption properties of protonation-induced tribranched chromophore having 1,3,5-triazine core and pyrrole end-groups.Synthetic Metals., 2011, 161, 783-788
  11. Dongpeng Yan, Jun Lu*, Jing Ma, Min Wei*, Shuangde Li, David G. Evans, and Xue Duan. Near-Infrared Absorption and Polarized Luminescent Ultrathin Films Based on Sulfonated Cyanines and Layered Double Hydroxide.J. Phys. Chem. C, 2011, 115, 7939-7946
  12. Shan He, Shitong Zhang, Jun Lu, Yufei Zhao, Jing Ma, Min Wei*, David G. Evans, Xue Duan. Enhancement of visible light photocatalysis by grafting ZnO nanoplatelets with exposed (0001) facets onto a hierarchical substrate.Chem. Commun., 2011, 47, 10797-10799
  13. Dongpeng Yan, Jun Lu,* Jing Ma, Shenghui Qin, Min Wei,* David G. Evans, and Xue Duan. Layered Host-Guest Materials with Reversible Piezochromic Luminescence. Angew. Chem. Int. Ed. 2011, 50, 7037-7040
  14. Lijun Yang, Shujuan Jiang, Yu Zhao, Lei Zhu, Sheng Chen, XizhangWang, QiangWu, Jing Ma, Yanwen Ma,* and Zheng Hu*. Boron-Doped Carbon Nanotubes as Metal-Free Electrocatalysts for the Oxygen Reduction Reaction.Angew. Chem. Int. Ed. 2011, 50, 7132-7135
  15. Hyun-Jung Kim, Xingyong Wang, Jing Ma*, Jun-Hyung Cho**. A density-functional-theory study of biradicals from benzene to hexacene.Chem. Phys. Lett. 2011, 516, 141-145
  16. Xingyong Wang and Jing Ma*. Electron Switch in the Double-Cage Fluorinated Fullerene Anions, e-@C20F18(XH)2C20F18 (X = N, B): New Candidates for Molecular Quantum-Dot Cellular Automata.Phys. Chem. Chem. Phys., 2011, 13, 16134-16137
  17. Jingbin Han, Yibo Dou, Dongpeng Yan, Jing Ma, Min Wei, David G. Evans and Xue Duan.Biomimetic design and assembly of organic-inorganic composite films with simultaneously enhanced strength and toughness.Chem. Commun., 2011, 47, 5274-5276
  18. Nan Jiang, Renxiang Tan, Jing Ma*.Simulations of Solid-State Vibrational Circular Dichroism Spectroscopy of (S)-Alternarlactam by Using Fragmentation Quantum Chemical Calculations.J. Phys. Chem. B 2011,115(12)2801-2813
  19. Shuguang Zhang, Jing Ma*. Width- and Edge-dependent Stability, Electronic Structures and Magnetic Properties of Graphene-like and Wurtzite ZnS Nanoribbons.J. Phys. Chem. C 2011,115(11)4466-4475
  20. Dongpeng Yan, Jun Lu,* Jing Ma, Min Wei,* David G. Evans, and Xue Duan.Reversibly Thermochromic, Fluorescent Ultrathin Films with a Supramolecular Architecture.Angew. Chem. Int. Ed. 2011, 123, 746-749
  21. Ying L. Zhang, Jie Zhang, Nan Jiang, Yan H. Lu, Lu Wang, Su H. Xu, Wei Wang, Gao F. Zhang, Qiang Xu, Hui M. Ge, Jing Ma, Yong C. Song, and Ren X. Tan*.Immunosuppressive Polyketides from Mantis-Associated Daldinia eschscholzii.J. Am. Chem. Soc. 2011, 133, 5931-5940
  22. Song-Song Bao, Yi Liao, Yan-Hui Su, Xu Liang, Feng-Chun Hu, Zhihu Sun, Li-Min Zheng,* Shiqiang Wei,* Roger Alberto, Yi-Zhi Li, Jing Ma* Tuning the Spin State of Cobalt in a Co-La Heterometallic Complex via Controllable Coordination Sphere of La.Angew. Chem. Int. Ed. 2011, 50, 5504-5508
  23. Zeyu Liu, Guo-Yuan Lu and Jing Ma*.Tuning the absorption spectra and nonlinear optical properties of D-pi-A azobenzene derivatives by changing the dipole moment and conjugation length: a theoretical study.J. Phys. Org. Chem.2011, 24, 568-577. DOI: 10.1002/poc.1792.
  1. Nan Jiang, Jing Ma* Influence of Disulfide Connectivity, Electrostatics, and Hydrophobicity on the Conformational Variations of α-Conotoxin GI Single-disulfide Analogues: Simulations with Polarizable Force Field J. Phys. Chem. B 2010, 114, 11241-11250
  2. Pang Juan, Hu Yang,* Jing Ma,* Rongshi Chen Solvation Behaviors of N-Isopropylacrylamide in Water/Methanol Mixtures Revealed by Molecular Dynamics Simulations J. Phys. Chem. B,2010, 114, 8652-8658
  3. Hui Cao,* Yi Luo, Jing Ma Field Effects on the Statistical Behavior of the Molecular Conductance in a Single Molecular Junction in Aqueous Solution Nano Res. 2010, 3, 350-355
  4. Shuang Chen, Jing Ma,* The Influence of Orientations and External Electric Field on Charge Carrier Mobilities in CuPc and F16CuPc Films on Highly Ordered Pyrolytic Graphite and Octane-1-thiol Terminated Au(111) Substrates Phys. Chem. Chem. Phys. 2010, 12,12177-12187
  5. Jean-Paul Malrieu,* Hongjiang Zhang, Jing Ma Ability of a coupled electron pair approximation to treat single bond breakings Chem. Phys. Lett. 2010,493, 179-184
  6. Hongjiang Zhang, Jean-Paul Malrieu, Peter Reinhardt, Jing Ma* Improved version of a local contracted configuration interaction of singles and doubles with partial inclusion of triples and quadruples J. Chem. Phys. 2010, 132, 034108
  7. Jin Wen and Jing Ma,* Oligothiophene Template Effects on Packings and Orientations of C60 Molecules on Ag(111) Surface Langmuir 2010, 26, 5595-5602
  8. Hui Feng, Jing Ma,* Zheng Hu,* Nitrogen-doped carbon nanotubes functionalized by transition metal atoms: a density functional study J. Mater. Chem. 2010, 20, 1702-1708
  9. Ai Hua Zhang, Nan Jiang, Wen Gu, Jing Ma, Yu Rong Wang, Yong Chun Song, Ren Xiang Tan* Characterization, Synthesis and Self-Aggregation of (-)-Alternarlactam: A New Fungal Cytotoxin with Cyclopentenone and Isoquinolinone Scaffolds Chem. Eur. J.2010, 16, 14479-14485
  10. Wei Hua Yuan, Min Liu, Nan Jiang, Zhi Kai Guo, Jing Ma, Jie Zhang, Yong Chun Song, Ren Xiang Tan* Guignardones A-C: Three Meroterpenes from Guignardia mangiferae Eur. J. Org. Chem.2010, 33, 6348-6353
  11. Dongpeng Yan, Jun Lu,* Jing Ma, Min Wei,* David G. Evans, Xue Duan Benzocarbazole anions intercalated layered double hydroxide and its tunable fluorescence Phys. Chem. Chem. Phys., 2010, 12, 15085-15092
  12. Dongpeng Yan, Shenghui Qin, Li Chen, Jun Lu,* Jing Ma, Min Wei,* David G. Evans, Xue Duan Thin film of sulfonated zinc phthalocyanine/layered double hydroxide for achieving multiple quantum well structure and polarized luminescence Chem. Commun. 2010, 46, 8654-8656
  13. Dongpeng Yan, Jun Lu,* Li Chen, Shenghui Qin, Jing Ma, Min Wei,* David G. Evans, Xue Duan A strategy to the ordered assembly of functional small cations with layered double hydroxides for luminescent ultra-thin films Chem. Commun. 2010, 46, 5912-5914
  14. Hong Yan, Min Wei,* Jing Ma, David G. Evans, Xue Duan Plane-Wave Density Functional Theory Study on the Structural and Energetic Properties of Cation-Disordered Mg-Al Layered Double Hydroxides J. Phys. Chem. A 2010, 114, 7369-7376
  15. Hong Yan, Min Wei,* Jing Ma, Xue Duan Density functional theory study on the influence of cation ratio on the host layer structure of Zn/Al double hydroxides PARTICUOLOGY 2010, 8, Sp. Iss. 212-220
  16. Hui Ming Ge, Wen Hao Yang, Yan Shen, Nan Jiang, Zhi Kai Guo, Qiong Luo, Qiang Xu, Jing Ma, Ren Xiang Tan* Immunosuppressive Resveratrol Aneuploids from Hopea chinensis Chem. Eur. J. 2010, 16, 6338-6345
  17. Xian-Fu Wu, You-Cai Hu, Shi-Shan Yu,* Nan Jiang, Jing Ma, Ren-Xiang Tan, Yong Li, Hai-Ning Lv, Jing Liu, Shuang-Gang Ma Lysidicins F-H, Three New Phloroglucinols from Lysidice rhodostegia Org. Lett. 2010, 12, 2390-2393
  18. Yu Li Huang, Hui Li, Jing Ma, Han Huang, Wei Chen* and Andrew T. S. Wee* Scanning Tunneling Microscopy Investigation of Self-Assembled CuPc/F16CuPc Binary Superstructures on Graphite Langmuir 2010, 26, 3329-3334
  19. Yu Li Huang, Wei Chen,* Hui Li, Jing Ma, Jens Pflaum, Andrew Thye Shen Wee,* Tunable Two-Dimensional Binary Molecular Networks Small 2010,6, 70-75
  20. Dongpeng Yan, Jun Lu, Jing Ma, Min Wei,* Xinrui Wang, David G. Evans and Xue Duan Anionic Poly(p-Phenylenevinylene)/Layered Double Hydroxide Ordered Ultrathin Films with Multiple Quantum Well Structure: A Combined Experimental and Theoretical Study Langmuir 2010, 26, 7007-7014
  21. Jingbin Han, Dongpeng Yan, Wenying Shi, Jing Ma, Hong Yan, Min Wei,* David C. Evans, Xue Duan Layer-by-Layer Ultrathin Films of Azobenzene-Containing Polymer/Layered Double Hydroxides with Reversible Photoresponsive Behavior J. Phys. Chem. B 2010, 114, 5678-5685
  22. Kelvin Hong Liang Zhang, Hui Li, Hongying Mao, Han Huang,Jing Ma, Andrew Thye Shen Wee, Wei Chen* Control of Two-Dimensional Ordering of F16CuPc on Bi/Ag(111): Effect of Interfacial Interactions J. Phys. Chem. C 2010, 114, 11234-11241
  23. Dongpeng Yan, Jun Lu,* Jing Ma, Min Wei,* Shenghui Qin, Li Chen, David G. Evans, Xue Duan Thin film of coumarin-3-carboxylate and surfactant co-intercalated layered double hydroxide with polarized photoluminescence: a joint experimental and molecular dynamics study J. Mater. Chem. 2010,20, 5016-5024
  1. Xiufen Yan, Nan Jiang, and Jing Ma* Theoretical study of interactions between human adult hemoglobin and acetate ion by polarizable force field and fragmentation quantum chemistry methods Science in China Series B-Chemistry, 2009, 52(11):1925-1931
  2. Dongpeng Yan, Jun Lu,* Min Wei,* Jing Ma, David G. Evansa and Xue Duana Layer-by-layer assembly of ruthenium(II) complex anion/layered double hydroxide ordered ultrathin films with polarized luminescence Chem. Commun., 2009, 42:6358-6360
  3. Dongpeng Yan,a Jun Lu,* Min Wei,* Jing Ma, David G. Evansa and Xue Duana A combined study based on experiment and molecular dynamics: perylene tetracarboxylate intercalated in a layered double hydroxide matrix Phys. Chem. Chem. Phys., 2009,11(40):9200-9209.
  4. Wei Chen,* Shuang Chen, Shi Chen, Yu Li Huang, Han Huang, Dong Chen Qi, Xing Yu Gao, Jing Ma,* and Andrew Thye Shen Wee* Orientation-controlled charge transfer at CuPc/F16CuPc interfaces J. Appl. Phys., 2009, 106(6): 064910
  5. Hui Feng, Jing Ma,* and Zheng Hu* Six-Membered-Ring-Based Radical Mechanism for Catalytic Growth of Carbon Nanotubes with Benzene Precursor J. Phys. Chem. C, 2009, 113, 16495-16502
  6. Hong Yan, Min Wei,* Jing Ma, Feng Li, David G. Evans, and Xue Duan Theoretical Study on the Structural Properties and Relative Stability of M(II)-Al Layered Double Hydroxides Based on a Cluster Model J. Phys. Chem. A, 2009, 113, 6133-6141
  7. Ting-Hai Yang, Yi Liao, Li-Min Zheng,* Robert E. Dinnebier,* Yan-Hui Sua and Jing Ma Tuning the field-induced magnetic transition in a layered cobalt phosphonate by reversible dehydration-hydration process Chem. Commun., 2009, 3023-3025.
  8. Jing Ma,* Satoshi Inagaki, Yong Wang Orbital Phase Designs of Diradicals Topics in Current Chemistry, 2009, Springer (Invited Review).
  9. Shuang Chen, Jing Ma* Charge Transport in Stacking Metal and Metal-Free Phthalocyanine Iodides. Effects of Packing, Dopants, External Electric Field, Central Metals, Core Modification, and Substitutions J. Comput. Chem., 2009, 30(13):1959-1972
  10. Nan Jiang, Jing Ma* Theoretical study of proton encircling modes in proton sponges with tetraamido/diamino quaternized macrocycles: the role of p -conjugated and aliphatic bridges Phys. Chem. Chem. Phys., 2009,11:5100-5109
  11. Dongpeng Yan, Jun Lu*, Min Wei*, Jingbin Han, Jing Ma, Feng Li, David G. Evans, Xue Duan Ordered Poly(p-phenylene)/Layered Double Hydroxide Ultrathin Films with Blue Luminescence by Layer-by-Layer Assembly Angew. Chem., 2009, 121:3119-3122
  12. Yong Wang and Jing Ma* Silylenes and germylenes: The activation of H-H bond in hydrogen molecule J. Organomet. Chem., 2009, 694(16) : 2567-2575
  13. Suci Meng, Jie Jiang, Yujuan Wang, Jing Ma* Modulation of electronic structures of thienylene vinylene oligomers by substituents and solvents: ground and excited states J.Phys.Org. Chem., 2009, 22(7): 670-679
  14. Jie Jiang, Suci Meng, Jing Ma* Electronic Structures of Di(thienylene vinylene) of Ground and Excited States: Vinylene- and Ring-Substitution Effects Chemical Journal of Chinese Universities, 2009,30(2):370-376
  15. Jin Wen , Jing Ma* The role of substrate in packing strucutures of sexithiophenes on Ag (111) surface: molecular dynamics simulations and quantum chemical calculations J.Theor. Comput. Chem., 2009, 8(4): 677-690
  16. Jinshui Liu, Nan Jiang, Jing Ma* and Xuezhong Du* Insight into Unusual Downfield NMR Shifts in the Inclusion Complex of Acridine Orange with Cucurbit[7]uril Eur. J. Org. Chem., 2009, 2009(29), 4931-4938.
  1. P. Reinhardt, H. Zhang, J. Ma, and J.-P. Malrieu A local contracted treatment of single and double excitations J. Chem. Phys. 2008, 129, 164106
  2. Dongpeng Yan, Jun Lu, Min Wei*, Hui Li, Jing Ma, Feng Li, David G. Evans, and Xue Duan In Situ Polymerization of the 4-Vinylbenzenesulfonic Anion in Ni-Al-Layered Double Hydroxide and Its Molecular Dynamic Simulation J. Phys. Chem. A 2008, 112, 7671-7681
  3. Hong Yan , Jun Lu , Min Wei*, Jing Ma, Hui Li, Jing He, David G. Evans, Xue Duan Theoretical study of the hexahydrated metal cations for the understanding of their template effects in the construction of layered double hydroxides J. Mol. Struct. (Theochem) 2008, 866, 34-45
  4. Yong Pei, Jing Ma*, and Xiao Cheng Zeng* Effects of Radical Site Location and Surface Doping on the Radical Chain-reaction on H-Si(100)-(2*1): A Density Functional Theory Study J. Phys. Chem. C 2008, 112 (41), 16078-16086
  5. Wei Chen*, Hui Li, Han Huang, Yuanxi Fu, Hong Liang Zhang, Jing Ma*, and Andrew Thye Shen Wee* Two-Dimensional Pentacene:3,4,9,10-Perylenetetracarboxylic Dianhydride Supramolecular Chiral Networks on Ag(111) J. Am. Chem. Soc. 2008, 130(37), 12285-12289
  6. Nan Jiang and Jing Ma Conformational Simulations of Aqueous Solvated a-Conotoxin GI and Its Single Disulfide Analogues Using a Polarizable Force Field Model J. Phys. Chem. A 2008, 112, 9854-9867
  7. Hui Cao, Jun Jiang, Jing Ma, and Yi Luo* Identification of Switching Mechanism in Molecular Junctions by Inelastic Electron Tunneling Spectroscopy J. Phys. Chem. C 2008, 112, 11018-11022
  8. Yi Liao, and Jing Ma Stacking and Solvent Effects on the Electronic and Optical Properties of Gold and Mercury Acetylide Aggregations: A Theoretical Study Organometallics 2008, 27(18), 4636-4648
  9. Hui Cao, Jun Jiang, Jing Ma, and Yi Luo* Temperature-Dependent Statistical Behavior of Single Molecular Conductance in Aqueous Solution J. Am. Chem. Soc. 2008, 130(21), 6674-6675
  10. Hui Li, Wei Li, Shuhua Li, and Jing Ma* Fragmentation-Based QM/MM Simulations: Length Dependence of Chain Dynamics and Hydrogen Bonding of Polyethylene Oxide and Polyethylene in Aqueous Solutions J. Phys. Chem. B. 2008, 112(23), 7061-7070
  11. Suci Meng, and Jing Ma Solvatochromic Shift of Donor-Acceptor Substituted Bithiophene in Solvents of Different Polarity: Quantum Chemical and Molecular Dynamics Simulations J. Phys. Chem. B 2008, 112, 4313-4322
  12. Chi Zhang*, Yuan Cao, Jinfang Zhang, Suci Meng, Tsuyoshi Matsumoto, Yinglin Song, Jing Ma, Zhaoxu Chen, Kazuyuki Tatsumi, Mark G. Humphrey* Modulation of Third-Order Nonlinear Optical Properties by Backbone Modification of Polymeric Pillared-Layer Heterometallic Clusters Adv. Mater. 2008, 20, 1870-1875
  1. Guiling Zhang, Jing Ma, and Jin Wen Interchain Impacts on Electronic Structures of Heterocyclic Oligomers and Polymers Containing Group 14, 15, and 16 Heteroatoms: Quantum Chemical Calculations in Combination with Molecular Dynamics Simulations J. Phys. Chem. B 2007, 111, 11670-11679
  2. Yong Wang, Jing Ma*, Satoshi Inagaki* Stable silicon-centered localized singlet 1,3-diradicals XSi(GeY2)2SiX: theoretical predictions J.Phys.Org.Chem.2007, 20, 649-655
  3. Hui Cao, Tao Fang, Shuhua Li, and Jing Ma Interfacial Charge Transfer and Transport in Polyacetylene-Based Heteroionic Junctions: Quantum Chemistry Calculations and Molecular Dynamics Simulations Macromolecules 2007, 40, 4363-4369
  4. Yunsheng Ma, Hui Li,Junjie Wang,Songsong Bao,Rong Cao,Yizhi Li,Jing Ma* and Limin Zheng* Three-Dimensional Lanthanide(III)-Copper(II) Compounds Based on an Unsymmetrical 2-Pyridylphosphonate Ligand: An Experimental and Theoretical Study Chem. Eur. J. 2007,13,4759-4769
  5. Suci Meng, Jing Ma, Yuansheng Jiang Solvent Effects on Electronic Structures and Chain Conformations of α-Oligothiophenes in Polar and Apolar Solutions J. Phys. Chem. B 2007, 111, 4128-4136
  6. Yong Pei and Jing Ma Effects of βC Substituents and Terminal Unsaturated Groups on H-Abstraction Reactions of Unsaturated Molecules on the H-Terminated Si(100)-(2_1): Density Functional Theory Investigations J. Phys. Chem. C 2007, 111, 5486-5492
  1. Yuji Naruse, Jing Ma, Kunihiro Takeuchi, Takahiro Nohara, Satoshi Inagaki π-Relaxation of the ring strain: design of polycyclic unsaturated silicon molecules Tetrahedron 2006, 62(18), 4491-4497
  2. Hui Li, Jing Ma, et al. Molecular Dynamics Modeling of the Structures and Binding Energies of α-Nickel Hydroxides and Nickel-Aluminum Layered Double Hydroxides Containing Various Interlayer Guest Anions Chem. Mater. 2006, 18, 4405-4414
  3. Nan Jiang, Jing Ma,Yuansheng Jiang Electrostatic field-adapted molecular fractionation with conjugated caps for energy calculations of charged biomolecules J. Chem. Phys. 2006, 124, 114112
  4. Yong Wang, Jing Ma Theoretical Study on Reactions of Nitroethylene with the Si(100)-2*1 Surface J. Phys. Chem. B 2006, 110, 5542-5546
  5. Yong Pei, Jing Ma Comparative Study on Reactions and Self-Directed Growth Mechanisms of Styrene Molecules on H-Terminated Si(111) and Si(100): Combining Quantum Chemistry and Molecular Mechanics Simulations Langmuir 2006, 22, 3040-3048
  6. Jing Ma, Shuahua Li, Wei Li A Multireference Configuration Interation Method Based on the Separated Electron Pair Wave Functions J.Comput.Chem. 2006, 27, 39-47
  1. Zhaoping Ni, Xiaoming Ren, Jing Ma*, Jingli Xie, Chunlin Ni, Zhida Chen,and Qingjin Meng* Theoretical Studies on the Magnetic Switching Controlled by Stacking Patterns of Bis(maleonitriledithiolato) Nickelate(III) Dimers J. Am. Chem. Soc. 2005; 127(41); 14330-14338.
  2. Yong Wang, Jing Ma and Satoshi Inagaki Theoretical design of singlet localized σ-diradicals: C(MH2)3C (M=Si,Ge,Sn,Pb) Tetrahedron Letters 2005, 46, 5567-5571
  3. Yujuan Wang, Jing Ma and Yuansheng Jiang Tuning of Electronic Structures of Poly(p-phenylenevinylene) Analogues of Phenyl, Thienyl, Furyl, and Pyrrolyl by Double-Bond Linkages of Group 14 and 15 Elements J. Phys. Chem. A. 2005; 109(32); 7197-7206
  4. Guiling Zhang, Jing Ma and Yuansheng Jiang Charge-Doped and Heteroatom-Substituted Polysilane, Poly(vinylenedisilanylene), and Poly(butadienylenedisilanylene): Electronic Structures and Band Gaps J. Phys. Chem. B. 2005; 109(28); 13499-13509
  5. Xin Chen, Jing Ma, Zheng Hu, Qiang Wu, and Yi Chen AlN Nanotube: Round or Faceted? J. Am. Chem. Soc. 2005,127(22),7982-7983.
  6. Yong Pei, Jing Ma, Electric Field Induced Switching Behaviors of Monolayer-Modified Silicon Surfaces: Surface Designs and Molecular Dynamics Simulations J. Am. Chem. Soc. 2005,127(18),6802-6813.
  7. Wang Y, Ma J, Inagaki S, et al. [2+2] cycloaddition reactions of ethylene derivatives with the Si(100)-2x1 surface: A theoretical study J. Phys. Chem. B 109 (11): 5199-5206 MAR 24 2005.
  8. Cao H, Ma J, Zhang GL, et al. Borole/thiophene cooligomers and copolymers with quinoid structures and biradical characters Macromolecules 38 (4): 1123-1130 FEB 22 2005.
  1. Guiling Zhang, Yong Pei, Jing Ma, Kailiang Yin, Cheng-Lung Chen Packing Structures and Packing Effects on Excitation Energies of Amorphous Phase Oligothiophenes J. Phys. Chem. B 2004, 108(22), 6988-6995.
  2. Jing Ma,* Yihong Ding, Kazutaka Hattori, and Satoshi Inagaki* Theoretical Designs of Singlet Localized 1,3-Diradicals J. Org. Chem. 2004, 69(12), 4245-4255.
  3. Hua Xu, Jing Ma, Xin Chen, Zheng Hu,* Kaifu Huo, Yi Chen The Electronic Structures and Formation Mechanisms of the Single-Walled BN Nanotube with Small Diameter J. Phys. Chem. B 2004, 108(13), 4024-4034.
  1. Shuhua Li*, Wei Li, Jing Ma A Quick Estimate of the Correlation Energy for AlkanesChinese J. Chem. 2003, 21, 1422-1429.
  2. Xiaoming Ren, Jing Ma, Changsheng Lu, Jinqing Meng*, et. al. Syntheses, crystal structures, ferroelectrics and magnetic properties of [R-BzPy](2)[Cu(mnt)(2)] complexes ([R-BzPy]+=1-(4 '-R-benzyl)pyridinium, R = NO2 or Br; mnt(2-) = maleonitriledithiolate) Daltont 2003, 7, 1345-1351
  3. Y. Pei, J. Ma, Y. Jiang, Formation Mechanisms and Packing Structures of Alkoxyl and Alkyl Monolayers on Si(111): Theoretical Studies with Quantum Chemistry and Molecular Simulation Models Langmuir 2003,19(18),7652.
  4. Jing Ma, Shuhua Li, Chungen Liu, Yuansheng Jiang* The valence bond calculations on conjugated hydrocarbons of medium to infinite sizes J. Chin Chem. Soc-Taip 50 (3B): 717-728 Sp. Iss.
  5. Haibo Ma, Yi Gao, Xin Li, Jing Ma, Chungen Liu, and Yuansheng Jiang,* Edge Structure Index for Evaluating the Ground State Properties of One-Dimensional Macro- to Suprabenzenoid Hydrocarbons as Examined by DMRG VB Calculations Internet Electronic Journal of Molecular Design 2003,2.
  6. Yuji Naruse, Jing Ma and Satoshi Inagaki,* s and p relaxation of strain in three-membered ring molecules (CH2)2X, (NH)2X, and (SiH2)2X (X=SiH2, PH, S) J. Phys. Chem. A 2003, 107, 2860-2864.
  7. G. Zhang, J. Ma, Y. Jiang, Effects of silole contents and doping on the electronic stuctures and band gaps of thiphene/silole copolymers Macromolecules 2003, 36, 2130.
  8. Shuhua Li,* Jing Ma and Yuansheng Jiang Pair correlated coupled cluster theory: An alternative multireference coupled cluster method J. Chem. Phys. 2003, 118: 5736-5745.
  1. Shuhua Li, Jing Ma and Yuansheng Jiang,* Heisenberg model and its applications to pi-conjugated systems J. Theor. Comput. Chem. 2002, 2, 351-373. (Review article)
  2. Mingli Yang, Shuhua Li, Jing Ma, Yuansheng Jiang,* An MP2 study of linear polarizabilities and second-order hyperpolarizabilities for centrosymmetric quaraines Chem. Phys. Lett. 2002, 354, 316-323.
  3. Zhongzhou Chen,Yanmei Li, Jing Ma, Bo Tan, Satoshi Inagaki, Yufen Zhao,* Activities of alpha-COOH vs.-COOH in N-phosphoryl glutamic acid: A theoretical study J. Phys. Chem. A, 2002, 106, 11565-11569.
  4. Jing Ma, Shuhua Li, and Yuansheng Jiang* Kekule-based valence bond model. II. Diels-Alder reactivity of polycyclic aromatic hydrocarbons Chinese J. Chem. 2002, 20, 1180-1192.
  5. Shuhua Li, Jing Ma and Yuansheng Jiang,* Kekule-based valence bond model. I. The ground-state properities of conjugated pi-systems Chinese J. Chem. 2002, 20, 1168-1180.
  6. Jing Ma,* Atsushi Hozaki, and Satoshi Inagaki Pentagon stability in cycloarsanes Phosphorus, silicon, and sulfur, 2002, 177, 1705.
  7. J. Ma, A. Hozaki, S. Inagaki, Pentagon stability: Cyclic delocalization of lone pairs through sigma-conjugation and design of polycyclophosphane Inorg. Chem. 2002, 41, 1876.
  8. J. Ma, S. Li, and Y. Jiang, A Time-Dependent DFT Study on Band Gaps and Effective Conjugation Lengths of Polyacetylene, Polyphenylene, Polypentafulvene, Polycyclopentadiene, Polypyrrole, Polyfuran, Polysilole, Polyphosphole, and Polythiophene Macromolecules 2002, 35, 1109.
  9. Shuhua Li,* Jing Ma and Yuansheng Jiang Linear Scaling Local Correlation Approach for Solving the Coupled Cluster Equations of Large Systems J. Comput. Chem. 2002, 1, 23.
  1. Yuji Naruse, Jing Ma and Satoshi Inagaki,* Relaxation of ring strain by introduction of a double bond Tetrahedron Lett. 2001, 42, 6553.
  2. Jing Ma, Hirotaka Ikeda, and Satoshi Inagaki,* Relative stabilities of the crossed vs. Linear Sigma-conjugated group 14 triplet diradicals E4H8 and E5H10 (E=C,Si,Ge,Sn): Orbital phase predictions Bull. Chem. Soc. Jpn. 2001, 74, 273.
  3. J. Ma, S. Inagaki, Orbital phase control of the preferential branching of chain molecules J. Am. Chem. Soc. 2001, 123, 1193.
  1. Shuhua Li, Jing Ma and Yuansheng Jiang,* Pair-Correlated configuration Interaction Method and Its Approximate Version for Solving the Electron Correlation Problem in Molecules Int. J. Quantum. Chem. 2000, 78, 153.
  2. Jing Ma, and Satoshi Inagaki,* Cyclic delocalization of the oxygen lone pair electrons in the unusual structures of disilaoxirane and 1,3-cyclodisiloxane J. Phys. Chem. A 2000, 104, 8989.
  3. Shuhua Li,* Jing Ma, Yuansheng Jiang,* Electron correlation and magnetism: A simple molecular orbital approach for predicting ground-state spins of conjugated hydrocarbons J. Phys. Chem. A 1997, 101, 5587.
  4. Shuhua Li, Jing Ma, Yuansheng Jiang,* Strength of spin coupling in high -spin organic molecules J. Phys. Chem. A 1997, 101, 5567.
  5. Jing Ma, Shuhua Li, Yuansheng Jiang,* Can the low-lying electronic states be described by the semiempirical valence bond approach J. Phys. Chem. A 1997, 101, 4770-4775.
  6. Shuhua Li, Jing Ma, Yuansheng Jiang,* Is ferromagnetic spin coupling constant within a homologous di- and triradicals J. Phys. Chem. 1996, 100, 4775.
  7. Jing Ma, Shuhua Li, Yuansheng Jiang,* An effective valence bond study on conjugated molecules containg four-membered rings. J. Phys. Chem. 1996, 100, 15068-15072.
  8. Shuhua Li, Jing Ma, Yuansheng Jiang,* Topological dependence of ferro-magnetic coupling strength in some conjugated radicals radicala Chem. Phys. Lett. 1995, 246, 221-227.