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Dequan Xiao, Ph.D. - Publications

Affiliations: 
Chemistry and Chemical Engineering University of New Haven 
Area:
Theoretical and Computational Chemistry
Website:
http://www.newhaven.edu/Faculty-Staff-Profiles/Dequan-Xiao/
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29 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
2019 Yang JJ, Liu X, Fang WH, Xiao D, Cui G. Photoinduced Carrier Dynamics at the Interface of Black Phosphorus and Bismuth Vanadate. The Journal of Physical Chemistry. A. PMID 31661964 DOI: 10.1021/Acs.Jpca.9B08726  0.328
2019 Deng Y, Ge Y, Xu M, Yu Q, Xiao D, Yao S, Ma D. Molybdenum Carbide: Controlling the Geometric and Electronic Structure of Noble Metals for the Activation of O-H and C-H Bonds. Accounts of Chemical Research. PMID 31411856 DOI: 10.1021/Acs.Accounts.9B00182  0.328
2017 Wu Y, Rudshteyn B, Warnke I, Xiao D, Batista VS. Mechanistic study of CO/CO2 conversion catalyzed by a biomimetic Ni(II)-iminothiolate complex International Journal of Quantum Chemistry. 118: e25555. DOI: 10.1002/Qua.25555  0.724
2016 Ge A, Rudshteyn B, Psciuk BT, Xiao D, Song J, Anfuso CL, Ricks AM, Batista VS, Lian T. Surface-Induced Anisotropic Binding of a Rhenium CO2-Reduction Catalyst on Rutile TiO2(110) Surfaces Journal of Physical Chemistry C. 120: 20970-20977. DOI: 10.1021/Acs.Jpcc.6B03165  0.727
2015 Fu L, Wang Z, Psciuk BT, Xiao D, Batista VS, Yan EC. Characterization of Parallel β-Sheets at Interfaces by Chiral Sum Frequency Generation Spectroscopy. The Journal of Physical Chemistry Letters. 6: 1310-5. PMID 26263128 DOI: 10.1021/Acs.Jpclett.5B00326  0.749
2015 Psciuk BT, Prémont-Schwarz M, Koeppe B, Keinan S, Xiao D, Nibbering ET, Batista VS. Correlating photoacidity to hydrogen-bond structure by using the local O-H stretching probe in hydrogen-bonded complexes of aromatic alcohols. The Journal of Physical Chemistry. A. 119: 4800-12. PMID 25879273 DOI: 10.1021/Acs.Jpca.5B01530  0.756
2015 Fu L, Wang Z, Psciuk BT, Xiao D, Batista VS, Yan ECY. Characterization of parallel β-sheets at interfaces by chiral sum frequency generation spectroscopy Journal of Physical Chemistry Letters. 6: 1310-1315. DOI: 10.1021/acs.jpclett.5b00326  0.731
2014 Mohammed OF, Xiao D, Batista VS, Nibbering ET. Excited-state intramolecular hydrogen transfer (ESIHT) of 1,8-dihydroxy-9,10-anthraquinone (DHAQ) characterized by ultrafast electronic and vibrational spectroscopy and computational modeling. The Journal of Physical Chemistry. A. 118: 3090-9. PMID 24684387 DOI: 10.1021/Jp501612F  0.51
2014 Psciuk BT, Prémont-Schwartz M, Koeppe B, Keinan S, Xiao D, Batista VS, Nibbering ETJ. Ultrafast IR spectroscopy of O-H stretching modes in 2-naphthol-acetonitrile photoacid-base complexes Optics Infobase Conference Papers.  0.729
2013 Poojari C, Xiao D, Batista VS, Strodel B. Membrane permeation induced by aggregates of human islet amyloid polypeptides. Biophysical Journal. 105: 2323-32. PMID 24268144 DOI: 10.1016/J.Bpj.2013.09.045  0.469
2013 Messina F, Prémont-Schwarz M, Braem O, Xiao D, Batista VS, Nibbering ET, Chergui M. Ultrafast solvent-assisted electronic level crossing in 1-naphthol. Angewandte Chemie (International Ed. in English). 52: 6871-5. PMID 23794205 DOI: 10.1002/Anie.201301931  0.47
2013 Fu L, Xiao D, Wang Z, Batista VS, Yan EC. Chiral sum frequency generation for in situ probing proton exchange in antiparallel β-sheets at interfaces. Journal of the American Chemical Society. 135: 3592-8. PMID 23394622 DOI: 10.1021/Ja3119527  0.507
2013 Prémont-Schwarz M, Xiao D, Sekharan S, Batista VS, Nibbering ETJ. Ultrafast OH-stretching frequency shifts of hydrogen-bonded 2-naphthol photoacid-base complexes in solution Epj Web of Conferences. 41. DOI: 10.1051/epjconf/20134106007  0.425
2013 Messina F, Prémont-Schwarz M, Braem O, Xiao D, Batista VS, Nibbering ETJ, Chergui M. Inside Back Cover: Ultrafast Solvent-Assisted Electronic Level Crossing in 1-Naphthol (Angew. Chem. Int. Ed. 27/2013) Angewandte Chemie International Edition. 52: 7043-7043. DOI: 10.1002/Anie.201304256  0.477
2013 Messina F, Prémont-Schwarz M, Braem O, Xiao D, Batista VS, Nibbering ETJ, Chergui M. Innenrücktitelbild: Ultrafast Solvent-Assisted Electronic Level Crossing in 1-Naphthol (Angew. Chem. 27/2013) Angewandte Chemie. 125: 7181-7181. DOI: 10.1002/Ange.201304256  0.476
2012 Xiao D, Fu L, Liu J, Batista VS, Yan EC. Amphiphilic adsorption of human islet amyloid polypeptide aggregates to lipid/aqueous interfaces. Journal of Molecular Biology. 421: 537-47. PMID 22210153 DOI: 10.1016/J.Jmb.2011.12.035  0.484
2012 Xiao D, Prémont-Schwarz M, Nibbering ET, Batista VS. Ultrafast vibrational frequency shifts induced by electronic excitations: naphthols in low dielectric media. The Journal of Physical Chemistry. A. 116: 2775-90. PMID 22044113 DOI: 10.1021/Jp208426V  0.534
2012 Anfuso CL, Xiao D, Ricks AM, Negre CFA, Batista VS, Lian T. Orientation of a series of CO2 reduction catalysts on single crystal TiO2 probed by phase-sensitive vibrational sum frequency generation spectroscopy (PS-VSFG) Journal of Physical Chemistry C. 116: 24107-24114. DOI: 10.1021/Jp307406J  0.556
2011 Prémont-Schwarz M, Xiao D, Batista VS, Nibbering ET. The O-H stretching mode of a prototypical photoacid as a local dielectric probe. The Journal of Physical Chemistry. A. 115: 10511-6. PMID 21851092 DOI: 10.1021/Jp207642K  0.525
2011 Xiao D, Martini LA, Snoeberger RC, Crabtree RH, Batista VS. Inverse design and synthesis of acac-coumarin anchors for robust TiO2 sensitization. Journal of the American Chemical Society. 133: 9014-22. PMID 21553881 DOI: 10.1021/Ja2020313  0.738
2011 Anfuso CL, Snoeberger RC, Ricks AM, Liu W, Xiao D, Batista VS, Lian T. Covalent attachment of a rhenium bipyridyl CO2 reduction catalyst to Rutile TiO2. Journal of the American Chemical Society. 133: 6922-5. PMID 21504161 DOI: 10.1021/Ja2013664  0.746
2010 Liu B, Najari A, Pan C, Leclerc M, Xiao D, Zou Y. New low bandgap dithienylbenzothiadiazole vinylene based copolymers: synthesis and photovoltaic properties. Macromolecular Rapid Communications. 31: 391-8. PMID 21590919 DOI: 10.1002/Marc.200900654  0.309
2010 Hu X, Xiao D, Keinan S, Asselberghs I, Therien MJ, Clays K, Yang W, Beratan DN. Predicting the frequency dispersion of electronic hyperpolarizabilities on the basis of absorption data and thomas-kuhn sum rules Journal of Physical Chemistry C. 114: 2349-2359. DOI: 10.1021/Jp911556X  0.545
2010 Xiao D, Snoeberger RC, Martini L, Crabtree RH, Batista VS. Inverse design of molecular chromophores for dye-sensitized solar cells Acs National Meeting Book of Abstracts.  0.711
2009 Lin Z, Lawrence CM, Xiao D, Kireev VV, Skourtis SS, Sessler JL, Beratan DN, Rubtsov IV. Modulating unimolecular charge transfer by exciting bridge vibrations. Journal of the American Chemical Society. 131: 18060-2. PMID 19928957 DOI: 10.1021/Ja907041T  0.552
2009 Beratan DN, Skourtis SS, Balabin IA, Balaeff A, Keinan S, Venkatramani R, Xiao D. Steering electrons on moving pathways. Accounts of Chemical Research. 42: 1669-78. PMID 19645446 DOI: 10.1021/Ar900123T  0.735
2009 Xiao D, Skourtis SS, Rubtsov IV, Beratan DN. Turning charge transfer on and off in a molecular interferometer with vibronic pathways. Nano Letters. 9: 1818-23. PMID 19435376 DOI: 10.1021/Nl8037695  0.54
2008 Xiao D, Bulat FA, Yang W, Beratan DN. A donor-nanotube paradigm for nonlinear optical materials. Nano Letters. 8: 2814-8. PMID 18698728 DOI: 10.1021/Nl801388Z  0.504
2008 Xiao D, Yang W, Beratan DN. Inverse molecular design in a tight-binding framework. The Journal of Chemical Physics. 129: 044106. PMID 18681633 DOI: 10.1063/1.2955756  0.516
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