Digital Commons @ New Haven

Tin Assisted Fully Exposed Platinum Clusters Stabilized on Defect-Rich Graphene for Dehydrogenation Reaction, Jiayun Zhang, Yuchen Deng, Xiangbin Cai, Yunlei Chen, Mi Peng, Zhimin Jia, Zheng Jiang, Pengju Ren, Siyu Yao, Jinglin Xie, Dequan Xiao, Xiao-Dong Wen, Ning Wang, Hongyang Liu, Ding Ma
Chemistry and Chemical Engineering Faculty Publications

A versatile route to fabricate single atom catalysts with high chemoselectivity, Xiaohui He, Qian He, Yuchen Deng, Mi Peng, Hongyu Chen, Ying Zhang, Siyu Yao, Mengtao Zhang, Dequan Xiao, Ding Ma, Binghui Ge, Hongbing Ji
Chemistry and Chemical Engineering Faculty Publications

Anchoring Cu 1 species over nanodiamond-graphene for semi-hydrogenation of acetylene, Fei Huang, Yuchen Deng, Yunlei Chen, Xiangbin Cai, Mi Peng, Zhimin Jia, Jinglin Xie, Dequan Xiao, Xiaodong Wen, Ning Wang, Zheng Jiang, Hongyang Liu, Ding Ma
Chemistry and Chemical Engineering Faculty Publications

Au@h-Al2O3 Analogic Yolk–Shell Nanocatalyst for Highly Selective Synthesis of Biomass-Derived D-xylonic Acid via Regulation of Structure Effects, Jiliang Ma, Zewei Liu, Junlong Song, Linxin Zhong, Dequan Xiao, Hongxia Xi, Xuehui Li, Runcang Sun, Xinwen Peng
Chemistry and Chemical Engineering Faculty Publications

Atomically Dispersed Pd on Nanodiamond/Graphene Hybrid for Selective Hydrogenation of Acetylene, Fei Huang, Yuchen Deng, Yunlei Chen, Xiangbin Cai, Mia Peng, Zhimin Jia, Pengju Ren, Dequan Xiao, Xiaodong Wen, Ning Wang, Hongyang Liu, Ding Ma
Chemistry and Chemical Engineering Faculty Publications

A Hierarchical Approach for Creating Electrically Conductive Network Structure in Polyurethane Nanocomposites using a Hybrid of Graphene Nanoplatelets, Carbon Black and Multi-Walled Carbon Nanotubes, Pashupati Pokharel, Dequan Xiao, Folarin Erogbogbo, Ozgur Keles, Dai Soo Lee
Chemistry and Chemical Engineering Faculty Publications

A Tutorial of the Inverse Molecular Design Theory in Tight-Binding Frameworks and Its Applications, Dequan Xiao, Rui Hu
Chemistry and Chemical Engineering Faculty Publications

Quantum Chemistry Analysis of Reaction Thermodynamics for Hydrogenation and Hydrogenolysis of Aromatic Biomass Model Compounds, Laurene Petitjean, Raphael Gagne, Evan Beach, Jason An, Paul Anastas, Dequan Xiao
Chemistry and Chemical Engineering Faculty Publications

Quantum Chemistry Analysis of Reaction Thermodynamics for Hydrogenation and Hydrogenolysis of Aromatic Biomass Model Compounds, Laurene Petitjean, Raphael Gagne, Evan Beach, Jason An, Paul Anastas, Dequan Xiao
Chemistry and Chemical Engineering Faculty Publications

Highly Selective Hydrogenation and Hydrogenolysis Using a Copper-doped Porous Metal Oxide Catalyst, Laurene Petitjean, Raphael Gagne, Evan Beach, Dequan Xiao, Paul Anastas
Chemistry and Chemical Engineering Faculty Publications

Correlating Photoacidity to Hydrogen-Bond Structure by Using the Local O–H Stretching Probe in Hydrogen-Bonded Complexes of Aromatic Alcohols, Brian T. Psciuk, Mirabelle Prémont-Schwarz, Benjamin Koeppe, Sharon Keinan, Dequan Xiao, Erik T.J. Nibbering, Victor Batista
Chemistry and Chemical Engineering Faculty Publications

Characterization of Parallel β-Sheets at Interfaces by Chiral Sum Frequency Generation Spectroscopy, Li Fu, Zhuguang Wang, Brian Psciuk, Dequan Xiao, Victor Batista, Elsa C.Y. Yan
Chemistry and Chemical Engineering Faculty Publications

Chiral Sum Frequency Generation for In Situ Probing Proton Exchange in Antiparallel β-Sheets at Interfaces, Li Fu, Dequan Xiao, Zhuguang Wang, Victor Batista, Elsa C.Y. Yan
Chemistry and Chemical Engineering Faculty Publications

Orientation of a Series of CO2 Reduction Catalysts on Single Crystal TiO2 Probed by Phase-Sensitive Vibrational Sum Frequency Generation Spectroscopy (PS-VSFG), Chanelle L. Anfuso, Dequan Xiao, Allen M. Ricks, Christian F.A. Negre, Victor S. Batista, Tianquan Lian
Chemistry and Chemical Engineering Faculty Publications

Effects of Thiophene Units on Substituted Benzothiadiazole and Benzodithiophene Copolymers for Photovoltaic Applications, Ping Ding, Yingping Zou, Cheng-Che Chu, Dequan Xiao, Chain-Shu Hsu
Chemistry and Chemical Engineering Faculty Publications

The O-H Stretching Mode of a Prototypical Photoacid as a Local Dielectric Probe, Mirabelle Prémont-Schwarz, Dequan Xiao, Victor Batista, Erik T.J. Nibbering
Chemistry and Chemical Engineering Faculty Publications

Covalent Attachment of a Rhenium Bipyridyl CO 2 Reduction Catalyst to Rutile TiO 2, Chanelle L. Anfuso, Robert C. Snoeberger III, Allen M. Ricks, Weimin Liu, Dequan Xiao, Victor S. Batista, Tianquan Lian
Chemistry and Chemical Engineering Faculty Publications

Predicting the Frequency Dispersion of Electronic Hyperpolarizabilities on the Basis of Absorption Data and Thomas−Kuhn Sum Rules, Xiangqian Hu, Dequan Xiao, Sharhar Keinan, Inge Asselberghs, Michael J. Therien, Koen Clays, Weitao Yang, David N. Beratan
Chemistry and Chemical Engineering Faculty Publications

New Low Bandgap Dithienylbenzothiadiazole Vinylene Based Copolymers: Synthesis and Photovoltaic Properties, Bo Liu, Ahmed Najari, Chunyue Pan, Mario LeClerc, Dequan Xiao, Yingping Zou
Chemistry and Chemical Engineering Faculty Publications

Steering Electrons on Moving Pathways, David N. Beratan, Spiros S. Skourtis, Ilya A. Balabin, Alexander Balaeff, Shahar Keinan, Ravindra Venkatramani, Dequan Xiao
Chemistry and Chemical Engineering Faculty Publications

Modulating Unimolecular Charge Transfer by Exciting Bridge Vibrations, Zhiwei Lin, Candace M. Lawrence, Dequan Xiao, Victor Kireev, Spiros S. Skourtis, Jonathan L. Sessler, David N. Beratan, Igor V. Rubtsov
Chemistry and Chemical Engineering Faculty Publications

A Donor-Nanotube Paradigm for Nonlinear Optical Materials, Dequan Xiao, Felipe A. Bulat, Weitao Yang, David N. Beratan
Chemistry and Chemical Engineering Faculty Publications