Qian Peng - Publications

Affiliations: 
2014-2016 Chemistry University of Oxford, Oxford, United Kingdom 

134 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Yu W, Zhang H, Yin PA, Zhou F, Wang Z, Wu W, Peng Q, Jiang H, Tang BZ. Restriction of Conformation Transformation in Excited State: An Aggregation-Induced Emission Building Block Based on Stable Exocyclic C=N Group. Iscience. 23: 101587. PMID 33089098 DOI: 10.1016/J.Isci.2020.101587  0.389
2020 Ou Q, Peng Q, Shuai Z. Computational screen-out strategy for electrically pumped organic laser materials. Nature Communications. 11: 4485. PMID 32901000 DOI: 10.1038/S41467-020-18144-X  0.32
2020 Zhang MY, Liang X, Ni DN, Liu DH, Peng Q, Zhao CH. 2-(Dimesitylboryl)phenyl-Substituted [2.2]Paracyclophanes Featuring Intense and Sign-Invertible Circularly Polarized Luminescence. Organic Letters. PMID 32820935 DOI: 10.1021/Acs.Orglett.0C02463  0.333
2020 Zhao YS, Zhou Z, Qiao C, Wang K, Liang J, Wei Z, Dong H, Zhang C, Yan Y, Wang L, Peng Q, Shuai Z. Experimentally observed reverse intersystem crossing-boosted lasing. Angewandte Chemie (International Ed. in English). PMID 32789916 DOI: 10.1002/Anie.202008940  0.348
2020 Ou Q, Peng Q, Shuai Z. Towards Quantitative Prediction of Fluorescence Quantum Efficiency Through Combining Direct Vibrational Conversion and Surface Crossing: BODIPYs as Example. The Journal of Physical Chemistry Letters. PMID 32787317 DOI: 10.1021/Acs.Jpclett.0C02054  0.32
2020 Chen G, Sun J, Peng Q, Sun Q, Wang G, Cai Y, Gu X, Shuai Z, Tang BZ. Biradical-Featured Stable Organic-Small-Molecule Photothermal Materials for Highly Efficient Solar-Driven Water Evaporation. Advanced Materials (Deerfield Beach, Fla.). e1908537. PMID 32519356 DOI: 10.1002/Adma.201908537  0.315
2020 Feng HT, Zeng J, Yin PA, Wang XD, Peng Q, Zhao Z, Lam JWY, Tang BZ. Tuning molecular emission of organic emitters from fluorescence to phosphorescence through push-pull electronic effects. Nature Communications. 11: 2617. PMID 32457319 DOI: 10.1038/S41467-020-16412-4  0.388
2020 Xiao L, Wang Z, Zhang C, Xie X, Ma H, Peng Q, An Z, Wang X, Shuai Z, Xiao M. Long Persistent Luminescence Enabled by Dissociation of Triplet Intermediate States in an Organic Guest/Host System. The Journal of Physical Chemistry Letters. PMID 32302138 DOI: 10.1021/Acs.Jpclett.0C00880  0.317
2020 Duan R, Han G, Zeng Y, Peng Q, Yi Y. Suppressing triplet decay in quinoidal singlet fission materials: the role of molecular planarity and rigidity. Physical Chemistry Chemical Physics : Pccp. PMID 32219273 DOI: 10.1039/C9Cp06987A  0.339
2020 Liu D, De J, Gao H, Ma S, Ou Q, Li S, Qin Z, Dong H, Liao Q, Xu B, Peng Q, Shuai Z, Tian W, Fu H, Zhang X, et al. Organic laser molecule with high-mobility, high photolumines-cence quantum yield and deep-blue lasing characteristics. Journal of the American Chemical Society. PMID 32186872 DOI: 10.1021/Jacs.0C00871  0.304
2020 Sun Y, Geng H, Peng Q, Shuai Z. Computational Study on the Charge Transport and Optical Spectra of Anthracene Derivatives in Aggregates. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 32182404 DOI: 10.1002/Cphc.202000187  0.35
2020 Zhang T, Luan YX, Zheng SJ, Peng Q, Ye M. Chiral Aluminum-Controlled Ni-catalyzed Enantioselective Synthesis of Indenes via C-CN Bond Activation. Angewandte Chemie (International Ed. in English). PMID 32067290 DOI: 10.1002/Anie.202001142  0.314
2020 Wang Y, Peng Q, Ou Q, Lin S, Shuai Z. Novel molecular descriptor for highly efficient (ΦTADF>90%) transition metal TADF Au(III) complexes Journal of Materials Chemistry. DOI: 10.1039/D0Ta07149H  0.349
2020 Chen D, Zhu D, Lin G, Du M, Shi D, Peng Q, Jiang L, Liu Z, Zhang G, Zhang D. New fused conjugated molecules with fused thiophene and pyran units for organic electronic materials Rsc Advances. 10: 12378-12383. DOI: 10.1039/D0Ra01984D  0.353
2020 Chen H, Deng Y, Zhu X, Wang L, Lv L, Wu X, Li Z, Shi Q, Peng A, Peng Q, Shuai Z, Zhao Z, Chen H, Huang H. Toward Achieving Single-Molecule White Electroluminescence from Dual Emission of Fluorescence and Phosphorescence Chemistry of Materials. 32: 4038-4044. DOI: 10.1021/Acs.Chemmater.0C00710  0.319
2020 Yin P, Wan Q, Niu Y, Peng Q, Wang Z, Li Y, Qin A, Shuai Z, Tang BZ. Theoretical and Experimental Investigations on the Aggregation‐Enhanced Emission from Dark State: Vibronic Coupling Effect Advanced Electronic Materials. 6: 2000255. DOI: 10.1002/Aelm.202000255  0.328
2019 Yang S, Yin PA, Li L, Peng Q, Gu X, Gao G, You J, Tang BZ. Crystallization-Induced Reverse from Dark to Bright Excited States for Construction of Solid-Emission-Tunable Squaraines. Angewandte Chemie (International Ed. in English). PMID 31872942 DOI: 10.1002/Anie.201914437  0.329
2019 Zhang XS, Huang YY, Zhang J, Meng W, Peng Q, Kong R, Xiao Z, Liu J, Huang M, Yi Y, Chen L, Fan Q, Liu Z, Zhang G, Jiang L, et al. Dicyclohepta[ijkl,uvwx]rubicene with Two Pentagons and Two Heptagons as a New Stable and Planar Non-benzenoid  Nanographene. Angewandte Chemie (International Ed. in English). PMID 31863545 DOI: 10.1002/Anie.201914416  0.343
2019 Li B, Gong Y, Wang L, Lin H, Li Q, Guo F, Li Z, Peng Q, Shuai Z, Zhao L, Zhang Y. High Efficient Organic Room-Temperature Phosphorescent Luminophores through Tuning Triplet States and Spin-Orbit Coupling with Incorporation of a Secondary Group. The Journal of Physical Chemistry Letters. PMID 31659902 DOI: 10.1021/Acs.Jpclett.9B02885  0.353
2019 Ma H, Yu H, Peng Q, An Z, Wang D, Shuai Z. Hydrogen Bonding Induced Morphology Dependence of Long-lived Organic Room-Temperature Phosphorescence: A Computational Study. The Journal of Physical Chemistry Letters. PMID 31652064 DOI: 10.1021/Acs.Jpclett.9B02568  0.318
2019 Lin S, Peng Q, Ou Q, Shuai Z. Strong Solid-State Fluorescence Induced by Restriction of the Coordinate Bond Bending in Two-Coordinate Copper(I)-Carbene Complexes. Inorganic Chemistry. PMID 31608622 DOI: 10.1021/Acs.Inorgchem.9B01705  0.384
2019 Tu Y, Liu J, Zhang H, Peng Q, Lam JWY, Tang BZ. Restriction of Access to Dark State: A New Mechanistic Model for Heteroatom-Containing AIE Systems. Angewandte Chemie (International Ed. in English). PMID 31343100 DOI: 10.1002/Anie.201907522  0.323
2019 Zhou B, Zhang YQ, Zhang K, Yang MY, Chen YB, Li Y, Peng Q, Zhu SF, Zhou QL, Ye LW. Stereoselective synthesis of medium lactams enabled by metal-free hydroalkoxylation/stereospecific [1,3]-rearrangement. Nature Communications. 10: 3234. PMID 31324800 DOI: 10.1038/S41467-019-11245-2  0.319
2019 Chai Z, Wang J, Xie Y, Lin P, Li H, Chang K, Xu T, Mei A, Peng Q, Wang M, Han H, Li Q, Li Z. Modulation of Acceptor Position in Organic Sensitizers: the Optimization of Intramolecular and Interfacial Charge Transfer Process. Acs Applied Materials & Interfaces. PMID 31305062 DOI: 10.1021/Acsami.9B03428  0.334
2019 Mao W, Wang Y, Xiang L, Peng Q, Leng X, Chen Y. Scandium Phosphonioketene: Synthesis, Bonding and Reactivity. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31199008 DOI: 10.1002/Chem.201902008  0.301
2019 Liu DH, Sun ZB, Zhao ZH, Peng Q, Zhao CH. 1,1'-Binaphthyl Consisting of Two Donor-π-acceptor Subunits:a General Skeleton for Temperature-Dependent Dual Fluorescence. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31141225 DOI: 10.1002/Chem.201901719  0.313
2019 Xue J, Liang Q, Wang R, Hou J, Li W, Peng Q, Shuai Z, Qiao J. Highly Efficient Thermally Activated Delayed Fluorescence via J-Aggregates with Strong Intermolecular Charge Transfer. Advanced Materials (Deerfield Beach, Fla.). e1808242. PMID 31081199 DOI: 10.1002/Adma.201808242  0.395
2019 Wang G, Liang X, Chen L, Gao Q, Wang JG, Zhang P, Peng Q, Xu S. Iridium-Catalyzed Distal Hydroboration of Aliphatic Internal Alkenes. Angewandte Chemie (International Ed. in English). PMID 30990948 DOI: 10.1002/Anie.201902464  0.316
2019 Sun ZB, Liu JK, Yuan DF, Zhao ZH, Zhu XZ, Liu DH, Peng Q, Zhao CH. 2,2'-Diamino-6,6'-diboryl-1,1'-binaphthyl: a Versatile Building Block for Temperature-dependent Dual Fluorescence and Switchable Circularly Polarized Lumincescence. Angewandte Chemie (International Ed. in English). PMID 30675973 DOI: 10.1002/Anie.201813320  0.33
2019 Zhang H, Liu J, Du L, Ma C, Leung NLC, Niu Y, Qin A, Sun J, Peng Q, Sung HHY, Williams ID, Kwok RTK, Lam JWY, Wong KS, Phillips DL, et al. Drawing a clear mechanistic picture for the aggregation-induced emission process Materials Chemistry Frontiers. 3: 1143-1150. DOI: 10.1039/C9Qm00156E  0.371
2019 Zheng X, Wang D, Xu W, Cao S, Peng Q, Tang BZ. Charge control of fluorescent probes to selectively target the cell membrane or mitochondria: theoretical prediction and experimental validation Materials Horizons. 6: 2016-2023. DOI: 10.1039/C9Mh00906J  0.305
2019 Bai Z, Zheng S, Bai Z, Song F, Wang H, Peng Q, Chen G, He G. Palladium-Catalyzed Amide-Directed Enantioselective Carboboration of Unactivated Alkenes Using a Chiral Monodentate Oxazoline Ligand Acs Catalysis. 9: 6502-6509. DOI: 10.1021/Acscatal.9B01350  0.355
2019 Xie Y, Gong Y, Han M, Zhang F, Peng Q, Xie G, Li Z. Tetraphenylcyclopentadiene-Based Hyperbranched Polymers:Convenient Syntheses from One Pot “A 4 + B 2 ” Polymerization and High External Quantum Yields up to 9.74%in OLED Devices Macromolecules. 52: 896-903. DOI: 10.1021/Acs.Macromol.8B02051  0.304
2019 Wu J, Wang Z, Chen X, Wu Y, Wang D, Peng Q, Wang P. Para-selective borylation of monosubstituted benzenes using a transient mediator Science China Chemistry. 63: 336-340. DOI: 10.1007/S11426-019-9652-X  0.306
2018 Dong YQ, Duan Y, Ma H, Tian H, Liu J, Deng X, Peng Q. Construction of a Luminogen Exhibiting High Contrast and Multicolored Emission Switching through Combination of a Bulky Conjugation Core and Toly Groups. Chemistry, An Asian Journal. PMID 30516343 DOI: 10.1002/Asia.201801608  0.333
2018 Tu XS, Zeng NN, Li RY, Zhao YQ, Xie DZ, Peng Q, Wang XC. C2-Symmetric Bicyclic Bis-Borane Catalysts: Kinetic or Thermodynamic Products from a Reversible Hydroboration of Dienes. Angewandte Chemie (International Ed. in English). PMID 30211963 DOI: 10.1002/Anie.201808289  0.31
2018 Zong L, Zhang H, Li Y, Gong Y, Li D, Wang J, Wang Z, Xie Y, Han M, Peng Q, Li X, Dong J, Qian J, Li Q, Li Z. Tunable Aggregation-Induced Emission Nanoparticles by Varying Isolation Groups in Perylene Diimide Derivatives and Application in Three-Photon Fluorescence Bio-Imaging. Acs Nano. PMID 30134104 DOI: 10.1021/Acsnano.8B05090  0.327
2018 Peng Q, Sage JT, Liu Y, Wang Z, Hu MY, Zhao J, Alp EE, Scheidt WR, Li J. How Does a Heme Carbene Differ from Diatomic Ligated (NO, CO, and CN) Analogues in the Axial Bond? Inorganic Chemistry. PMID 30010336 DOI: 10.1021/Acs.Inorgchem.8B00574  0.311
2018 Liu F, Tu J, Wang X, Wang J, Gong Y, Han M, Dang X, Liao Q, Peng Q, Li Q, Li Z. Opposite mechanoluminescence behavior of two isomers with different linkage positions. Chemical Communications (Cambridge, England). PMID 29767198 DOI: 10.1039/C8Cc03083A  0.323
2018 Xiong Y, Zhao Z, Zhao WJ, Ma HL, Peng Q, He ZK, Zhang XP, Chen YC, He XW, Lam J, Tang BZ. Design Efficient and Ultralong Pure Organic Room-Temperature Phosphorescent Materials by Structural Isomerism. Angewandte Chemie (International Ed. in English). PMID 29736955 DOI: 10.1002/Anie.201800834  0.361
2018 Yang J, Zhen X, Wang B, Gao X, Ren Z, Wang J, Xie Y, Li J, Peng Q, Pu K, Li Z. The influence of the molecular packing on the room temperature phosphorescence of purely organic luminogens. Nature Communications. 9: 840. PMID 29483501 DOI: 10.1038/S41467-018-03236-6  0.347
2018 Wang H, Bai Z, Jiao T, Deng Z, Tong H, He G, Peng Q, Chen G. Palladium-Catalyzed Amide-Directed Enantioselective Hydrocarbo-functionalization of Unactivated Alkenes Using a Chiral Monodentate Oxazoline Ligand. Journal of the American Chemical Society. PMID 29474067 DOI: 10.1021/Jacs.8B00641  0.348
2018 Peng Q, Wang Z, Zaric SD, Brothers EN, Hall MB. Unraveling the Role of a Flexible Tetradentate Ligand in the Aerobic Oxidative Carbon-Carbon Bond Formation with Palladium Complexes: A Computational Mechanistic Study. Journal of the American Chemical Society. PMID 29444572 DOI: 10.1021/Jacs.7B11701  0.332
2018 Hu MY, He Q, Fan SJ, Wang ZC, Liu LY, Mu YJ, Peng Q, Zhu SF. Ligands with 1,10-phenanthroline scaffold for highly regioselective iron-catalyzed alkene hydrosilylation. Nature Communications. 9: 221. PMID 29335560 DOI: 10.1038/S41467-017-02472-6  0.321
2018 Niu Y, Li W, Peng Q, Geng H, Yi Y, Wang L, Nan G, Wang D, Shuai Z. MOlecular MAterials Property Prediction Package (MOMAP) 1.0: a software package for predicting the luminescent properties and mobility of organic functional materials Molecular Physics. 116: 1078-1090. DOI: 10.1080/00268976.2017.1402966  0.325
2018 Fang M, Yang J, Xiang X, Xie Y, Dong Y, Peng Q, Li Q, Li Z. Unexpected room-temperature phosphorescence from a non-aromatic, low molecular weight, pure organic molecule through the intermolecular hydrogen bond Materials Chemistry Frontiers. 2: 2124-2129. DOI: 10.1039/C8Qm00396C  0.337
2018 Ni J, Liu H, Liu J, Jiang M, Zhao Z, Chen Y, Kwok RTK, Lam JWY, Peng Q, Tang BZ. The unusual aggregation-induced emission of coplanar organoboron isomers and their lipid droplet-specific applications Materials Chemistry Frontiers. 2: 1498-1507. DOI: 10.1039/C8Qm00184G  0.38
2018 Tong H, Zheng S, Li X, Deng Z, Wang H, He G, Peng Q, Chen G. Pd(0)-Catalyzed Bidentate Auxiliary Directed Enantioselective Benzylic C–H Arylation of 3-Arylpropanamides Using the BINOL Phosphoramidite Ligand Acs Catalysis. 8: 11502-11512. DOI: 10.1021/Acscatal.8B03654  0.304
2018 Huang J, Liu W, Zheng BH, Liu XY, Yang Z, Ding C, Li H, Peng Q, Hou X. Pd-Catalyzed Asymmetric Cyclopropanation Reaction of Acyclic Amides with Allyl and Polyenyl Carbonates. Experimental and Computational Studies for the Origin of Cyclopropane Formation Acs Catalysis. 1964-1972. DOI: 10.1021/Acscatal.7B03744  0.325
2018 Zhang X, Jacquemin D, Peng Q, Shuai Z, Escudero D. General Approach To Compute Phosphorescent OLED Efficiency Journal of Physical Chemistry C. 122: 6340-6347. DOI: 10.1021/Acs.Jpcc.8B00831  0.351
2018 Duan R, Peng Q, Shen X, Han G, Guo Y, Zeng Y, Yi Y. Decay of the Lowest Triplet State in Singlet-Fission Molecular Materials: A Case Study on Quinoidal Bithiophenes Journal of Physical Chemistry C. 122: 3748-3755. DOI: 10.1021/Acs.Jpcc.7B11646  0.345
2018 Fu L, Geng H, Wang G, Duan Y, Geng Y, Peng Q, Zhu R, Xiao T, Wang W, Liao Y. Effect of electron-withdrawing terminal group on BDT-based donor materials for organic solar cells: a theoretical investigation Theoretical Chemistry Accounts. 137: 63. DOI: 10.1007/S00214-018-2242-Z  0.331
2018 Yang J, Guo Q, Wang J, Ren Z, Chen J, Peng Q, Ma D, Li Z. Rational Molecular Design for Efficient Exciton Harvesting, and Deep‐Blue OLED Application Advanced Optical Materials. 6: 1800342. DOI: 10.1002/Adom.201800342  0.372
2018 Yang L, Ye P, Li W, Zhang W, Guan Q, Ye C, Dong T, Wu X, Zhao W, Gu X, Peng Q, Tang B, Huang H. Uncommon Aggregation-Induced Emission Molecular Materials with Highly Planar Conformations Advanced Optical Materials. 6: 1701394. DOI: 10.1002/Adom.201701394  0.309
2017 Yang J, Qin J, Ren Z, Peng Q, Xie G, Li Z. Pyrene-Based Blue AIEgen: Enhanced Hole Mobility and Good EL Performance in Solution-Processed OLEDs. Molecules (Basel, Switzerland). 22. PMID 29207563 DOI: 10.3390/Molecules22122144  0.357
2017 Suo JJ, Du J, Liu QR, Chen D, Ding CH, Peng Q, Hou XL. Highly Diastereo- and Enantioselective Palladium-Catalyzed [3 + 2] Cycloaddition of Vinyl Epoxides and α,β-Unsaturated Ketones. Organic Letters. PMID 29164892 DOI: 10.1021/Acs.Orglett.7B03386  0.3
2017 Liu J, Pan L, Peng Q, Qin A. Tetraphenylpyrimidine-Based AIEgens: Facile Preparation, Theoretical Investigation and Practical Application. Molecules (Basel, Switzerland). 22. PMID 28994729 DOI: 10.3390/Molecules22101679  0.365
2017 Luo W, Nie H, He B, Zhao Z, Peng Q, Tang BZ. Spectroscopically and Theoretically Depicting Through-Space Conjugation of Foldamers with a Tetraphenylethene Hinge. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 28985454 DOI: 10.1002/Chem.201704182  0.329
2017 Li YJ, Hong Y, Peng Q, Yao J, Zhao YS. Orientation-Dependent Exciton-Plasmon Coupling in Embedded Organic/Metal Nanowire Heterostructures. Acs Nano. PMID 28930431 DOI: 10.1021/Acsnano.7B04584  0.322
2017 Wang C, Liu Z, Li M, Xie Y, Li B, Wang S, Xue S, Peng Q, Chen B, Zhao Z, Li Q, Ge Z, Li Z. The marriage of AIE and interface engineering: convenient synthesis and enhanced photovoltaic performance. Chemical Science. 8: 3750-3758. PMID 28553533 DOI: 10.1039/C6Sc05648B  0.312
2017 Tang R, Zhou S, Cheng Z, Yu G, Peng Q, Zeng H, Guo G, Li Q, Li Z. Janus second-order nonlinear optical dendrimers: their controllable molecular topology and corresponding largely enhanced performance. Chemical Science. 8: 340-347. PMID 28451178 DOI: 10.1039/C6Sc02956F  0.313
2017 You X, Ma H, Wang Y, Zhang G, Peng Q, Liu L, Wang S, Zhang D. Pyridinium substituted tetraphenylethylene entailing alkyne moiety: enhancement of photosensitizing efficiency and antimicrobial activity. Chemistry, An Asian Journal. PMID 28294561 DOI: 10.1002/Asia.201700243  0.37
2017 Xie Y, Ge Y, Peng Q, Li C, Li Q, Li Z. How the Molecular Packing Affects the Room Temperature Phosphorescence in Pure Organic Compounds: Ingenious Molecular Design, Detailed Crystal Analysis, and Rational Theoretical Calculations. Advanced Materials (Deerfield Beach, Fla.). PMID 28221726 DOI: 10.1002/Adma.201606829  0.311
2017 Shuai Z, Peng Q. Organic light-emitting diodes: theoretical understanding of highly efficient materials and development of computational methodology National Science Review. 4: 224-239. DOI: 10.1093/Nsr/Nww024  0.382
2017 Yang J, Ren Z, Chen B, Fang M, Zhao Z, Tang BZ, Peng Q, Li Z. Three polymorphs of one luminogen: how the molecular packing affects the RTP and AIE properties? Journal of Materials Chemistry C. 5: 9242-9246. DOI: 10.1039/C7Tc03656F  0.3
2017 Fang M, Yang J, Liao Q, Gong Y, Xie Z, Chi Z, Peng Q, Li Q, Li Z. Triphenylamine derivatives: different molecular packing and the corresponding mechanoluminescent or mechanochromism property Journal of Materials Chemistry C. 5: 9879-9885. DOI: 10.1039/C7Tc03641H  0.302
2017 Yang J, Guo Q, Ren Z, Gao X, Peng Q, Li Q, Ma D, Li Z. New insight into intramolecular conjugation in the design of efficient blue materials: from the control of emission to absorption Journal of Materials Chemistry C. 5: 6185-6192. DOI: 10.1039/C7Tc01308F  0.315
2017 Zhan X, Zhang J, Gong Y, Tang S, Tu J, Xie Y, Peng Q, Yu G, Li Z. Alkyl chain engineering of pyrene-fused perylene diimides: impact on transport ability and microfiber self-assembly Materials Chemistry Frontiers. 1: 2341-2348. DOI: 10.1039/C7Qm00268H  0.317
2017 Yang J, Gao Y, Jiang T, Liu W, Liu C, Lu N, Li B, Mei J, Peng Q, Hua J. Substituent effects on the aggregation-induced emission and two-photon absorption properties of triphenylamine–dibenzo[a,c]phenazine adducts Materials Chemistry Frontiers. 1: 1396-1405. DOI: 10.1039/C7Qm00024C  0.332
2017 Nie H, Hu K, Cai Y, Peng Q, Zhao Z, Hu R, Chen J, Su S, Qin A, Tang BZ. Tetraphenylfuran: aggregation-induced emission or aggregation-caused quenching? Materials Chemistry Frontiers. 1: 1125-1129. DOI: 10.1039/C6Qm00343E  0.344
2017 Yang J, Li L, Yu Y, Ren Z, Peng Q, Ye S, Li Q, Li Z. Blue pyrene-based AIEgens: inhibited intermolecular π–π stacking through the introduction of substituents with controllable intramolecular conjugation, and high external quantum efficiencies up to 3.46% in non-doped OLEDs Materials Chemistry Frontiers. 1: 91-99. DOI: 10.1039/C6Qm00014B  0.325
2017 Ardkhean R, Roth PMC, Maksymowicz RM, Curran A, Peng Q, Paton RS, Fletcher SP. Enantioselective Conjugate Addition Catalyzed by a Copper Phosphoramidite Complex: Computational and Experimental Exploration of Asymmetric Induction Acs Catalysis. 7: 6729-6737. DOI: 10.1021/Acscatal.7B01453  0.715
2017 Peng Q, Fan D, Duan R, Yi Y, Niu Y, Wang D, Shuai Z. Theoretical Study of Conversion and Decay Processes of Excited Triplet and Singlet States in a Thermally Activated Delayed Fluorescence Molecule Journal of Physical Chemistry C. 121: 13448-13456. DOI: 10.1021/Acs.Jpcc.7B00692  0.32
2017 Li W, Peng Q, Ma H, Wen J, Ma J, Peteanu LA, Shuai Z. Theoretical Investigations on the Roles of Intramolecular Structure Distortion versus Irregular Intermolecular Packing in Optical Spectra of 6T Nanoparticles Chemistry of Materials. 29: 2513-2520. DOI: 10.1021/Acs.Chemmater.6B04210  0.303
2017 Zong L, Gong Y, Yu Y, Xie Y, Xie G, Peng Q, Li Q, Li Z. New perylene diimide derivatives: stable red emission, adjustable property from ACQ to AIE, and good device performance with an EQE value of 4.93% Chinese Science Bulletin. 63: 108-116. DOI: 10.1016/J.Scib.2017.10.021  0.368
2017 Li W, Zhu L, Shi Q, Ren J, Peng Q, Shuai Z. Excitonic coupling effect on the nonradiative decay rate in molecular aggregates: Formalism and application Chemical Physics Letters. 683: 507-514. DOI: 10.1016/J.Cplett.2017.03.077  0.317
2017 Yuan WZ, Bin X, Chen G, He Z, Liu J, Ma H, Peng Q, Wei B, Gong Y, Lu Y, He G, Zhang Y. Achieving Hybridized Local and Charge-Transfer Excited State and Excellent OLED Performance Through Facile Doping Advanced Optical Materials. 5: 1700466. DOI: 10.1002/Adom.201700466  0.365
2016 Zhan X, Wu Z, Lin Y, Xie Y, Peng Q, Li Q, Ma D, Li Z. Benzene-cored AIEgens for deep-blue OLEDs: high performance without hole-transporting layers, and unexpected excellent host for orange emission as a side-effect. Chemical Science. 7: 4355-4363. PMID 30155082 DOI: 10.1039/C6Sc00559D  0.343
2016 Choi H, Min M, Peng Q, Kang D, Paton RS, Hong S. Unraveling innate substrate control in site-selective palladium-catalyzed C-H heterocycle functionalization. Chemical Science. 7: 3900-3909. PMID 30155034 DOI: 10.1039/C5Sc04590H  0.58
2016 Roose J, Leung ACS, Wang J, Peng Q, Sung HH, Williams ID, Tang BZ. A colour-tunable chiral AIEgen: reversible coordination, enantiomer discrimination and morphology visualization. Chemical Science. 7: 6106-6114. PMID 30034751 DOI: 10.1039/C6Sc01614F  0.355
2016 Zhang T, Peng Q, Quan C, Nie H, Niu Y, Xie Y, Zhao Z, Tang BZ, Shuai Z. Using the isotope effect to probe an aggregation induced emission mechanism: theoretical prediction and experimental validation. Chemical Science. 7: 5573-5580. PMID 30034698 DOI: 10.1039/C6Sc00839A  0.33
2016 Deb A, Peng Q, Hazra A, Paton RS, Maiti D. Detailed Mechanistic Studies on Palladium Catalyzed Selective C-H Olefination with Aliphatic Alkenes: A Significant Influence of Proton Shuttling. Journal of the American Chemical Society. PMID 27997801 DOI: 10.1021/Jacs.6B10309  0.598
2016 Yang J, Ren Z, Xie Z, Liu Y, Wang C, Xie Y, Peng Q, Xu B, Tian W, Zhang F, Chi Z, Li Q, Li Z. AIEgen with Fluorescence-Phosphorescence Dual Mechanoluminescence at Room Temperature. Angewandte Chemie (International Ed. in English). PMID 27936297 DOI: 10.1002/Anie.201610453  0.355
2016 Peng Q, Duarte F, Paton RS. Computing organic stereoselectivity - from concepts to quantitative calculations and predictions. Chemical Society Reviews. PMID 27722685 DOI: 10.1039/C6Cs00573J  0.684
2016 Chai Z, Wan S, Zhong C, Xu T, Fang M, Wang J, Xie Y, Zhang Y, Mei A, Han H, Peng Q, Li Q, Li Z. Conjugated or Broken: the Introduction of Isolation Spacer ahead of the Anchoring Moiety, and the Improved Device Performance. Acs Applied Materials & Interfaces. PMID 27700025 DOI: 10.1021/Acsami.6B10030  0.318
2016 Ruan Z, Li L, Wang C, Xie Y, Hu Q, Peng Q, Ye S, Li Q, Li Z. Tetraphenylcyclopentadiene Derivatives: Aggregation-Induced Emission, Adjustable Luminescence from Green to Blue, Efficient Undoped OLED Performance and Good Mechanochromic Properties. Small (Weinheim An Der Bergstrasse, Germany). PMID 27671549 DOI: 10.1002/Smll.201602285  0.333
2016 Zheng X, Peng Q, Zhu L, Xie Y, Huang X, Shuai Z. Unraveling the aggregation effect on amorphous phase AIE luminogens: a computational study. Nanoscale. PMID 27417250 DOI: 10.1039/C6Nr03599J  0.354
2016 Peng Q, Paton RS. Catalytic Control in Cyclizations: From Computational Mechanistic Understanding to Selectivity Prediction. Accounts of Chemical Research. PMID 27137131 DOI: 10.1021/Acs.Accounts.6B00084  0.623
2016 Fu H, Yu Z, Wu Y, Peng Q, Sun C, Chen J, Yao J. Accessing the Triplet State in Heavy-Atom-Free Perylene Diimides. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 26853213 DOI: 10.1002/Chem.201600300  0.34
2016 Straker RN, Peng Q, Mekareeya A, Paton RS, Anderson EA. Computational ligand design in enantio- and diastereoselective ynamide [5+2] cycloisomerization. Nature Communications. 7: 10109. PMID 26728968 DOI: 10.1038/Ncomms10109  0.594
2016 Yang J, Guo Q, Wen X, Gao X, Peng Q, Li Q, Ma D, Li Z. Pyrene-based blue AIEgens: tunable intramolecular conjugation, good hole mobility and reversible mechanochromism Journal of Materials Chemistry C. 4: 8506-8513. DOI: 10.1039/C6Tc02533A  0.334
2016 Peng Q, Shi Q, Niu Y, Yi Y, Sun S, Li W, Shuai Z. Understanding the efficiency drooping of the deep blue organometallic phosphors: a computational study of radiative and non-radiative decay rates for triplets Journal of Materials Chemistry C. 4: 6829-6838. DOI: 10.1039/C6Tc00858E  0.413
2016 Liu Y, Lam JWY, Zheng X, Peng Q, Kwok RTK, Sung HHY, Williams ID, Tang BZ. Aggregation-Induced Emission and Photocyclization of Poly(hexaphenyl-1,3-butadiene)s Synthesized from “1 + 2” Polycoupling of Internal Alkynes and Arylboronic Acids Macromolecules. 49: 5817-5830. DOI: 10.1021/Acs.Macromol.6B01148  0.353
2016 Zhang Y, Ma H, Wang S, Li Z, Ye K, Zhang J, Liu Y, Peng Q, Wang Y. Supramolecular Structure-Dependent Thermally-Activated Delayed Fluorescence (TADF) Properties of Organic Polymorphs The Journal of Physical Chemistry C. 120: 19759-19767. DOI: 10.1021/Acs.Jpcc.6B05537  0.363
2016 Zhan X, Yang M, Yuan L, Gong Y, Xie Y, Peng Q, Ye S, Li Q, Li Z. Prying into the limit of CIE value for TPE-based blue AIEgens in organic light-emitting diodes Dyes and Pigments. 128: 60-67. DOI: 10.1016/J.Dyepig.2016.01.001  0.35
2015 Gong Y, Zhao L, Peng Q, Fan D, Yuan WZ, Zhang Y, Tang BZ. Crystallization-induced dual emission from metal- and heavy atom-free aromatic acids and esters. Chemical Science. 6: 4438-4444. PMID 29142698 DOI: 10.1039/C5Sc00253B  0.337
2015 Yao W, Han G, Huang F, Chu M, Peng Q, Hu F, Yi Y, Jiang H, Yao J, Zhao YS. "H"-like Organic Nanowire Heterojunctions Constructed from Cooperative Molecular Assembly for Photonic Applications. Advanced Science (Weinheim, Baden-Wurttemberg, Germany). 2: 1500130. PMID 27980915 DOI: 10.1002/Advs.201500130  0.305
2015 Bu F, Duan R, Xie Y, Yi Y, Peng Q, Hu R, Qin A, Zhao Z, Tang BZ. Unusual Aggregation-Induced Emission of a Coumarin Derivative as a Result of the Restriction of Intramolecular Twisting Motion. Angewandte Chemie (International Ed. in English). PMID 26439884 DOI: 10.1002/Anie.201506782  0.331
2015 Chen G, Li W, Zhou T, Peng Q, Zhai D, Li H, Yuan WZ, Zhang Y, Tang BZ. Conjugation-Induced Rigidity in Twisting Molecules: Filling the Gap Between Aggregation-Caused Quenching and Aggregation-Induced Emission. Advanced Materials (Deerfield Beach, Fla.). PMID 26135057 DOI: 10.1002/Adma.201501981  0.336
2015 Fang C, Xie Y, Johnston MR, Ruan Y, Tang BZ, Peng Q, Tang Y. SERS and NMR Studies of Typical Aggregation-induced Emission Molecules. The Journal of Physical Chemistry. A. PMID 26106798 DOI: 10.1021/Acs.Jpca.5B05478  0.318
2015 Shuai Z, Peng Q, Xie Y, Zhang T, Li Z, Yi Y. Influences of extent of conjugation on the aggregation-induced emission quantum efficiency in silole derivatives - A computational study. Chemistry, An Asian Journal. PMID 26083577 DOI: 10.1002/Asia.201500303  0.345
2015 Bu F, Wang E, Peng Q, Hu R, Qin A, Zhao Z, Tang BZ. Structural and theoretical insights into the AIE attributes of phosphindole oxide: the balance between rigidity and flexibility. Chemistry (Weinheim An Der Bergstrasse, Germany). 21: 4440-9. PMID 25656497 DOI: 10.1002/Chem.201405902  0.355
2015 Fan D, Yi Y, Li Z, Liu W, Peng Q, Shuai Z. Solvent effects on the optical spectra and excited-state decay of triphenylamine-thiadiazole with hybridized local excitation and intramolecular charge transfer. The Journal of Physical Chemistry. A. 119: 5233-40. PMID 25402947 DOI: 10.1021/Jp5099409  0.34
2015 Zhan X, Wu Z, Lin Y, Tang S, Yang J, Hu J, Peng Q, Ma D, Li Q, Li Z. New AIEgens containing dibenzothiophene-S,S-dioxide and tetraphenylethene moieties: Similar structures but very different hole/electron transport properties Journal of Materials Chemistry C. 3: 5903-5909. DOI: 10.1039/C5Tc01028D  0.318
2015 Yang J, Sun N, Huang J, Li Q, Peng Q, Tang X, Dong Y, Ma D, Li Z. New AIEgens containing tetraphenylethene and silole moieties: tunable intramolecular conjugation, aggregation-induced emission characteristics and good device performance Journal of Materials Chemistry C. 3: 2624-2631. DOI: 10.1039/C4Tc02631D  0.342
2015 Zhang T, Ma H, Niu Y, Li W, Wang D, Peng Q, Shuai Z, Liang W. Spectroscopic Signature of the Aggregation-Induced Emission Phenomena Caused by Restricted Nonradiative Decay: A Theoretical Proposal Journal of Physical Chemistry C. 119: 5040-5047. DOI: 10.1021/Acs.Jpcc.5B01323  0.315
2015 Zhan X, Sun N, Wu Z, Tu J, Yuan L, Tang X, Xie Y, Peng Q, Dong Y, Li Q, Ma D, Li Z. Polyphenylbenzene as a platform for deep-blue OLEDs: Aggregation enhanced emission and high external quantum efficiency of 3.98% Chemistry of Materials. 27: 1847-1854. DOI: 10.1021/Acs.Chemmater.5B00094  0.34
2014 Jiang Y, Geng H, Shi W, Peng Q, Zheng X, Shuai Z. Theoretical Prediction of Isotope Effects on Charge Transport in Organic Semiconductors. The Journal of Physical Chemistry Letters. 5: 2267-73. PMID 26279545 DOI: 10.1021/Jz500825Q  0.302
2014 Leung NL, Xie N, Yuan W, Liu Y, Wu Q, Peng Q, Miao Q, Lam JW, Tang BZ. Restriction of intramolecular motions: the general mechanism behind aggregation-induced emission. Chemistry (Weinheim An Der Bergstrasse, Germany). 20: 15349-53. PMID 25303769 DOI: 10.1002/Chem.201403811  0.324
2014 Zhang T, Jiang Y, Niu Y, Wang D, Peng Q, Shuai Z. Aggregation effects on the optical emission of 1,1,2,3,4,5-hexaphenylsilole (HPS): a QM/MM study. The Journal of Physical Chemistry. A. 118: 9094-104. PMID 24921662 DOI: 10.1021/Jp5021017  0.352
2014 Wang H, Xie L, Peng Q, Meng L, Wang Y, Yi Y, Wang P. Novel thermally activated delayed fluorescence materials-thioxanthone derivatives and their applications for highly efficient OLEDs. Advanced Materials (Deerfield Beach, Fla.). 26: 5198-204. PMID 24903266 DOI: 10.1002/Adma.201401393  0.342
2014 Shuai Z, Wang D, Peng Q, Geng H. Computational evaluation of optoelectronic properties for organic/carbon materials. Accounts of Chemical Research. 47: 3301-9. PMID 24702037 DOI: 10.1021/Ar400306K  0.367
2014 Wu Q, Zhang T, Peng Q, Wang D, Shuai Z. Aggregation induced blue-shifted emission--the molecular picture from a QM/MM study. Physical Chemistry Chemical Physics : Pccp. 16: 5545-52. PMID 24509542 DOI: 10.1039/C3Cp54910K  0.362
2014 Shuai Z, Peng Q. Excited states structure and processes: Understanding organic light-emitting diodes at the molecular level Physics Reports. 537: 123-156. DOI: 10.1016/J.Physrep.2013.12.002  0.383
2013 Peng Q, Niu Y, Shi Q, Gao X, Shuai Z. Correlation Function Formalism for Triplet Excited State Decay: Combined Spin-Orbit and Nonadiabatic Couplings. Journal of Chemical Theory and Computation. 9: 1132-43. PMID 26588756 DOI: 10.1021/Ct300798T  0.323
2013 Bourbon P, Peng Q, Ferraudi G, Stauffacher C, Wiest O, Helquist P. Development of carbamate-tethered coumarins as phototriggers for caged nicotinamide. Bioorganic & Medicinal Chemistry Letters. 23: 6321-4. PMID 24125882 DOI: 10.1016/J.Bmcl.2013.09.067  0.326
2013 Cai Z, Zhang H, Geng H, Liu Z, Yang S, Luo H, Jiang L, Peng Q, Zhang G, Chen J, Yi Y, Hu W, Zhang D. Thiepin-fused heteroacenes: simple synthesis, unusual structure, and semiconductors with less anisotropic behavior. Chemistry (Weinheim An Der Bergstrasse, Germany). 19: 14573-80. PMID 24105874 DOI: 10.1002/Chem.201302114  0.34
2013 Cai Z, Guo Y, Yang S, Peng Q, Luo H, Liu Z, Zhang G, Liu Y, Zhang D. New Donor–Acceptor–Donor Molecules with Pechmann Dye as the Core Moiety for Solution-Processed Good-Performance Organic Field-Effect Transistors Chemistry of Materials. 25: 471-478. DOI: 10.1021/Cm303793G  0.323
2013 Shuai Z, Xu W, Peng Q, Geng H. From electronic excited state theory to the property predictions of organic optoelectronic materials Science China-Chemistry. 56: 1277-1284. DOI: 10.1007/S11426-013-4916-7  0.328
2012 Peng Q, Yan H, Zhang X, Wu YD. Conjugate addition vs Heck reaction: a theoretical study on competitive coupling catalyzed by isoelectronic metal (Pd(II) and Rh(I)). The Journal of Organic Chemistry. 77: 7487-96. PMID 22876853 DOI: 10.1021/Jo301319J  0.335
2012 Wu Q, Deng C, Peng Q, Niu Y, Shuai Z. Quantum chemical insights into the aggregation induced emission phenomena: a QM/MM study for pyrazine derivatives. Journal of Computational Chemistry. 33: 1862-9. PMID 22622704 DOI: 10.1002/Jcc.23019  0.356
2012 Gao X, Peng Q, Niu Y, Wang D, Shuai Z. Theoretical insight into the aggregation induced emission phenomena of diphenyldibenzofulvene: a nonadiabatic molecular dynamics study. Physical Chemistry Chemical Physics : Pccp. 14: 14207-16. PMID 22491526 DOI: 10.1039/C2Cp40347A  0.361
2012 Wu Q, Peng Q, Niu Y, Gao X, Shuai Z. Theoretical insights into the aggregation-induced emission by hydrogen bonding: a QM/MM study. The Journal of Physical Chemistry. A. 116: 3881-8. PMID 22455476 DOI: 10.1021/Jp3002367  0.35
2012 Huang G, Ma B, Chen J, Peng Q, Zhang G, Fan Q, Zhang D. Dendron-containing tetraphenylethylene compounds: dependence of fluorescence and photocyclization reactivity on the dendron generation. Chemistry (Weinheim An Der Bergstrasse, Germany). 18: 3886-92. PMID 22362603 DOI: 10.1002/Chem.201103675  0.326
2012 Bourbon P, Peng Q, Ferraudi G, Stauffacher C, Wiest O, Helquist P. Synthesis, photophysical, photochemical, and computational studies of coumarin-labeled nicotinamide derivatives. The Journal of Organic Chemistry. 77: 2756-62. PMID 22360284 DOI: 10.1021/Jo2025527  0.361
2012 Jiang Y, Peng Q, Gao X, Shuai Z, Niu Y, Lin SH. Theoretical design of polythienylenevinylene derivatives for improvements of light-emitting and photovoltaic performances Journal of Materials Chemistry. 22: 4491-4501. DOI: 10.1039/C1Jm14956C  0.355
2011 Geng H, Niu Y, Peng Q, Shuai Z, Coropceanu V, Brédas JL. Theoretical study of substitution effects on molecular reorganization energy in organic semiconductors. The Journal of Chemical Physics. 135: 104703. PMID 21932914 DOI: 10.1063/1.3632105  0.301
2011 Deng C, Niu Y, Peng Q, Qin A, Shuai Z, Tang BZ. Theoretical study of radiative and non-radiative decay processes in pyrazine derivatives. Journal of Chemical Physics. 135: 14304. PMID 21744899 DOI: 10.1063/1.3606579  0.358
2011 Peng Q, Niu Y, Wang Z, Jiang Y, Li Y, Liu Y, Shuai Z. Theoretical predictions of red and near-infrared strongly emitting X-annulated rylenes. The Journal of Chemical Physics. 134: 074510. PMID 21341862 DOI: 10.1063/1.3549143  0.31
2010 Niu Y, Peng Q, Deng C, Gao X, Shuai Z. Theory of excited state decays and optical spectra: application to polyatomic molecules. Journal of Physical Chemistry A. 114: 7817-7831. PMID 20666533 DOI: 10.1021/Jp101568F  0.316
2010 Peng Q, Niu Y, Deng C, Shuai Z. Vibration correlation function formalism of radiative and non-radiative rates for complex molecules Chemical Physics. 370: 215-222. DOI: 10.1016/J.Chemphys.2010.03.004  0.363
2008 Wu WQ, Peng Q, Dong DX, Hou XL, Wu YD. A dramatic switch of enantioselectivity in asymmetric heck reaction by benzylic substituents of ligands. Journal of the American Chemical Society. 130: 9717-25. PMID 18590334 DOI: 10.1021/Ja7104174  0.34
2008 Zhang K, Peng Q, Hou XL, Wu YD. Highly enantioselective palladium-catalyzed alkylation of acyclic amides. Angewandte Chemie (International Ed. in English). 47: 1741-4. PMID 18214868 DOI: 10.1002/Anie.200704629  0.327
2007 Peng Q, Yi Y, Shuai Z, Shao J. Toward quantitative prediction of molecular fluorescence quantum efficiency: role of duschinsky rotation. Journal of the American Chemical Society. 129: 9333-9. PMID 17622142 DOI: 10.1021/Ja067946E  0.387
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