☰

Yi Zhao - Publications

Affiliations: 
2003-2007 Chemical Physics University of Science and Technology of China, Hefei Shi, Anhui Sheng, China 
 2007- Chemistry Xiamen University, P.R.C 
Tree Info Similar researchers PubMed Report error

41 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 Feng S, Wang YC, Ke Y, Liang W, Zhao Y. Effect of charge-transfer states on the vibrationally resolved absorption spectra and exciton dynamics in ZnPc aggregates: Simulations from a non-Makovian stochastic Schrödinger equation. The Journal of Chemical Physics. 153: 034116. PMID 32716176 DOI: 10.1063/5.0013935  0.308
2020 Piontkowski Z, Wang Y, Liu Y, Zhao Y, McCamant DW. Electron Transfer in Rhodamine–TiO2 Complexes Studied as a Function of Chalcogen and Bridge Substitution The Journal of Physical Chemistry C. 124: 2851-2863. DOI: 10.1021/Acs.Jpcc.9B11049  0.341
2016 Zhao H, Wang W, Zhao Y. Thermal Rate Constants for the O((3)P)+CH4→OH+CH3 Reaction: The Effects of Quantum Tunneling and Potential Energy Barrier Shape. The Journal of Physical Chemistry. A. PMID 27640428 DOI: 10.1021/Acs.Jpca.6B07029  0.307
2016 Ke Y, Zhao Y. Hierarchy of forward-backward stochastic Schrödinger equation. The Journal of Chemical Physics. 145: 024101. PMID 27421391 DOI: 10.1063/1.4955107  0.305
2016 Zang H, Ke Y, Zhao Y, Liang W. Effects of Charge Transfer State and Exciton Migration on Singlet Fission Dynamics in Organic Aggregates Journal of Physical Chemistry C. 120: 13351-13359. DOI: 10.1021/Acs.Jpcc.6B02943  0.311
2016 Wu WP, Deng LL, Li X, Zhao Y. Theoretical insight into the stereometric effect of bisPC71BM on polymer cell performance Science Bulletin. 1-9. DOI: 10.1007/S11434-015-0984-8  0.32
2015 Ye C, Zhao Y, Liang W. Resonance Raman spectra of organic molecules absorbed on inorganic semiconducting surfaces: Contribution from both localized intramolecular excitation and intermolecular charge transfer excitation. The Journal of Chemical Physics. 143: 154105. PMID 26493895 DOI: 10.1063/1.4933374  0.301
2015 Si Y, Yang B, Qin H, Yuan J, Wang S, Chen H, Zhao Y. Atomistic Modeling of Triplet–Triplet Energy-Transfer Rates from Drug (S)-Propranolol to (R)-Cinacalcet in Human α1-Acid Glycoprotein Journal of Physical Chemistry C. 119: 8014-8022. DOI: 10.1021/Jp512844Q  0.322
2015 Han L, Ke Y, Zhong X, Zhao Y. Time-dependent wavepacket diffusion method and its applications in organic semiconductors International Journal of Quantum Chemistry. 115: 578-588. DOI: 10.1002/Qua.24833  0.308
2014 Han L, Zhong X, Liang W, Zhao Y. Energy relaxation and separation of a hot electron-hole pair in organic aggregates from a time-dependent wavepacket diffusion method. The Journal of Chemical Physics. 140: 214107. PMID 24907990 DOI: 10.1063/1.4879955  0.327
2014 Ma H, Zhao Y, Liang W. Assessment of mode-mixing and Herzberg-Teller effects on two-photon absorption and resonance hyper-Raman spectra from a time-dependent approach. The Journal of Chemical Physics. 140: 094107. PMID 24606353 DOI: 10.1063/1.4867273  0.305
2014 Leng C, Qin H, Si Y, Zhao Y. Theoretical prediction of the rate constants for exciton dissociation and charge recombination to a triplet state in pcpdtbt with different fullerene derivatives Journal of Physical Chemistry C. 118: 1843-1855. DOI: 10.1021/Jp410562U  0.333
2013 Zhong X, Zhao Y. Non-Markovian stochastic Schrödinger equation at finite temperatures for charge carrier dynamics in organic crystals. Journal of Chemical Physics. 138: 14111-14111. PMID 23298032 DOI: 10.1063/1.4773319  0.324
2012 Yang J, Zhang W, Si Y, Zhao Y. Intramolecular electronic couplings in class II/III organic mixed-valence systems of bis(1,4-dimethoxybenzene). Journal of Physical Chemistry B. 116: 14126-14135. PMID 23145540 DOI: 10.1021/Jp308242S  0.307
2012 Zhang W, Zhong X, Zhao Y. Electron mobilities of n-type organic semiconductors from time-dependent wavepacket diffusion method: Pentacenequinone derivatives Journal of Physical Chemistry A. 116: 11075-11082. PMID 22483224 DOI: 10.1021/Jp3023474  0.339
2012 Wu W, Cao Z, Zhao Y. Theoretical studies on absorption, emission, and resonance Raman spectra of Coumarin 343 isomers Journal of Chemical Physics. 136: 114305-114305. PMID 22443762 DOI: 10.1063/1.3693264  0.309
2012 Zhao Y, Liang W. Charge transfer in organic molecules for solar cells: theoretical perspective. Chemical Society Reviews. 41: 1075-87. PMID 22105355 DOI: 10.1039/C1Cs15207F  0.338
2012 Si Y, Liang W, Zhao Y. Theoretical prediction of triplet-triplet energy transfer rates in a benzophenone-fluorene-naphthalene system Journal of Physical Chemistry C. 116: 12499-12507. DOI: 10.1021/Jp303705D  0.345
2011 Zhao Y, Liang W. Theoretical investigation of resonance Raman scattering of dye molecules absorbed on semiconductor surfaces. The Journal of Chemical Physics. 135: 044108. PMID 21806091 DOI: 10.1063/1.3615057  0.317
2011 Qin H, Zhong X, Si Y, Zhang W, Zhao Y. Effect of group electronegativity on electron transfer in bis(hydrazine) radical cations. Journal of Physical Chemistry A. 115: 3116-3121. PMID 21413730 DOI: 10.1021/Jp110724F  0.322
2011 Si Y, Zhong X, Zhang W, Zhao Y. Theoretical Investigation on Triplet Excitation Energy Transfer in Fluorene Dimer Chinese Journal of Chemical Physics. 24: 538-546. DOI: 10.1088/1674-0068/24/05/538-546  0.348
2011 Zhang W, Zhao Y, Liang W. Theoretical investigation of the non-Condon effect on electron transfer: Application to organic semiconductor Science China-Chemistry. 54: 707-714. DOI: 10.1007/S11426-011-4255-5  0.343
2010 Zhang W, Liang W, Zhao Y. Non-Condon effect on charge transport in dithiophene-tetrathiafulvalene crystal. The Journal of Chemical Physics. 133: 024501. PMID 20632757 DOI: 10.1063/1.3456545  0.337
2009 Telo JP, Nelsen SF, Zhao Y. Electron transfer within charge-localized dinitroaromatic radical anions. The Journal of Physical Chemistry. A. 113: 7730-6. PMID 19505069 DOI: 10.1021/Jp9017508  0.327
2009 Zhao Y, Liang W. Non-Condon nature of fluctuating bridges on nonadiabatic electron transfer: analytical interpretation. The Journal of Chemical Physics. 130: 034111. PMID 19173514 DOI: 10.1063/1.3063095  0.328
2009 Chu X, Zhao Y. Effect of environment on superexchange electron transfer in a multiple bridged donor-acceptor system Journal of Theoretical and Computational Chemistry. 8: 1295-1307. DOI: 10.1142/S0219633609005337  0.338
2009 Nan G, Yang X, Wang L, Shuai Z, Zhao Y. Nuclear tunneling effects of charge transport in rubrene, tetracene, and pentacene Physical Review B. 79: 115203. DOI: 10.1103/Physrevb.79.115203  0.312
2008 Zhang W, Zhu W, Liang W, Zhao Y, Nelsen SF. Ab initio calculations on the intramolecular electron transfer rates of a bis(hydrazine) radical cation. The Journal of Physical Chemistry. B. 112: 11079-86. PMID 18683973 DOI: 10.1021/Jp8036507  0.331
2008 Zhao Y. Density matrix analysis and simulation of electron dynamics in multiple-bridged donor/acceptor molecules under dissipative environments Journal of Theoretical and Computational Chemistry. 7: 869-877. DOI: 10.1142/S0219633608004179  0.333
2007 Gao F, Zhao Y, Liang W. Theoretical studies toward understanding the excited state dynamics of a bichromophoric molecule. The Journal of Chemical Physics. 126: 224509. PMID 17581065 DOI: 10.1063/1.2741559  0.338
2007 Zhu W, Zhao Y. Quantum effect of intramolecular high-frequency vibrational modes on diffusion-controlled electron transfer rate: From the weak to the strong electronic coupling regions Journal of Chemical Physics. 126: 184105-184105. PMID 17508790 DOI: 10.1063/1.2735323  0.347
2007 Nelsen SF, Konradsson AE, Weaver MN, Stephenson RM, Lockard JV, Zink JI, Zhao Y. Comparisons of measured rate constants with spectroscopically determined electron-transfer parameters. The Journal of Physical Chemistry. B. 111: 6776-81. PMID 17388559 DOI: 10.1021/Jp069032K  0.349
2007 Zhao Y, Han M, Liang W, Nakamura H. Semiclassical treatment of thermally activated electron transfer in the inverted region under the fast dielectric relaxation. The Journal of Physical Chemistry. A. 111: 2047-53. PMID 17311366 DOI: 10.1021/Jp066565K  0.35
2007 Zhu W, Han M, Zhao Y. Electron transfer dynamics in solution using imaginary-time split operator approach Chinese Journal of Chemical Physics. 20: 217-223. DOI: 10.1088/1674-0068/20/03/217-223  0.302
2006 Zhao Y, Liang W, Nakamura H. Semiclassical treatment of thermally activated electron transfer in the intermediate to strong electronic coupling regime under the fast dielectric relaxation. The Journal of Physical Chemistry. A. 110: 8204-12. PMID 16805508 DOI: 10.1021/Jp061513G  0.353
2006 Liang W, Zhao Y, Sun J, Song J, Hu S, Yang J. Electronic excitation of polyfluorenes: a theoretical study. The Journal of Physical Chemistry. B. 110: 9908-15. PMID 16706446 DOI: 10.1021/Jp0572481  0.312
2006 Zhao Y, Li X, Zheng Z, Liang W. Semiclassical calculation of nonadiabatic thermal rate constants: application to condensed phase reactions. The Journal of Chemical Physics. 124: 114508. PMID 16555902 DOI: 10.1063/1.2178323  0.323
2006 Zhao Y, Liang W. Quantum Kramers-like theory of the electron-transfer rate from weak-to-strong electronic coupling regions Physical Review a - Atomic, Molecular, and Optical Physics. 74. DOI: 10.1103/Physreva.74.032706  0.337
2006 Song J, Liang WZ, Zhao Y, Yang J. Conformational flexibility and its effect on the vibrationally resolved absorption and fluorescence spectra of oligofluorenes Applied Physics Letters. 89: 071917. DOI: 10.1063/1.2337530  0.334
2005 Zhao Y, Mil’nikov G. Electron transfer rate in the Marcus inverted regime beyond the perturbation theory Chemical Physics Letters. 413: 362-366. DOI: 10.1016/J.Cplett.2005.08.016  0.352
2004 Zhao Y, Mil’nikov G, Nakamura H. Evaluation of canonical and microcanonical nonadiabatic reaction rate constants by using the Zhu-Nakamura formulas. Journal of Chemical Physics. 121: 8854-8860. PMID 15527348 DOI: 10.1063/1.1801971  0.303
Show low-probability matches.