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Department Publications


Sherbo, R. S. ; Delima, R. S. ; Chiykowski, V. A. ; MacLeod, B. P. ; Berlinguette, C. P. Complete Electron Economy By Pairing Electrolysis With Hydrogenation. Nature Catalysis 2018, 1, 501–507.
Zimmerman, A. C. ; Fryzuk, M. D. Beta-Hydrogen Elimination And Reductive Elimination From A K-3-Ppc Nickel Complex. ORGANOMETALLICS 2018, 37, 2305-2318.
Vargas-Hernández, R. A. ; Sous, J. ; Berciu, M. ; Krems, R. V. Extrapolating Quantum Observables With Machine Learning: Inferring Multiple Phase Transitions From Properties Of A Single Phase. Phys. Rev. Lett. 2018, 121, 255702.
Wang, P. - X. ; MacLachlan, M. J. Liquid Crystalline Tactoids: Ordered Structure, Defective Coalescence And Evolution In Confined Geometries. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences 2018.
Kreitzman, S. R. ; Cottrell, S. P. ; Fleming, D. G. ; Sun-Mack, S. Understanding The Double Quantum Muonium Rf Resonance. In Proceedings of the 14th International Conference on Muon Spin Rotation, Relaxation and Resonance ($μ$SR2017); Proceedings of the 14th International Conference on Muon Spin Rotation, Relaxation and Resonance ($μ$SR2017); 2018.
Weber, P. ; Nasseri, S. A. ; Pabst, B. M. ; Torvisco, A. ; Müller, P. ; Paschke, E. ; Tschernutter, M. ; Windischhofer, W. ; Withers, S. G. ; Wrodnigg, T. M. ; , Potent Gh20 N-Acetyl-$\beta$-D-Hexosaminidase Inhibitors: N-Substituted 3-Acetamido-4-Amino-5-Hydroxymethyl-Cyclopentanediols. Molecules 2018, 23, 708.
Choi, J. R. ; Nilghaz, A. ; Chen, L. ; Chou, K. C. ; Lu, X. N. Modification Of Thread-Based Microfluidic Device With Polysiloxanes For The Development Of A Sensitive And Selective Immunoassay. Sensors and Actuators B-Chemical 2018, 260, 1043-1051.
Wang, L. ; Tong, W. ; Chen, D. Da Yong Optimization Of Dynamic Ph Barrage Junction Focusing For Weakly Alkaline Or Zwitterionic Analytes In Capillary Electrophoresis. Journal of Chromatography B 2018, 1095, 94 - 102.
Sous, J. ; Chakraborty, M. ; Krems, R. V. ; Berciu, M. Light Bipolarons Stabilized By Peierls Electron-Phonon Coupling. Phys. Rev. Lett. 2018, 121, 247001.
Oechsle, A. - L. ; Lewis, L. ; Hamad, W. Y. ; Hatzikiriakos, S. G. ; MacLachlan, M. J. Co2-Switchable Cellulose Nanocrystal Hydrogels. Chemistry of Materials 2018.
Chong, D. P. Mp2 Or B3Lyp: Computed Bond Distances Compared With Ccsd(T)/cc-Pvqz. Canadian Journal of Chemistry 2018, 96, 336-339.
Zhao, X. ; Shen, Y. ; Tong, W. ; Wang, G. ; Chen, D. Da Yong Deducing Disulfide Patterns Of Cysteine-Rich Proteins Using Signature Fragments Produced By Top-Down Mass Spectrometry. Analyst 2018, 143, 817-823.
Hettle, A. G. ; Vickers, C. ; Robb, C. S. ; Liu, F. ; Withers, S. G. ; Hehemann, J. - H. ; Boraston, A. B. The Molecular Basis Of Polysaccharide Sulfatase Activity And A Nomenclature For Catalytic Subsites In This Class Of Enzyme. Structure 2018.
Cheng, Q. ; Su, W. ; Hengqing, F. ; B., T. Robin F. ; Huihui, L. ; Y., C. David D. Pressure-Assisted Capillary Electrophoresis Frontal Analysis For Faster Binding Constant Determination. ELECTROPHORESIS 2018, 39, 1786-1793.
Han, Y. ; Chen, L. ; Liu, Y. G. ; Wang, Z. ; Zhang, H. W. ; Yang, K. ; Chou, K. C. Orbital Angular Momentum Transition Of Light Using A Cylindrical Vector Beam. Optics Letters 2018, 43, 2146-2149.
Hanna, S. J. ; Xu, J. - W. ; Schroder, J. C. ; Wang, Q. ; McMeeking, G. R. ; Hayden, K. ; Leaitch, W. R. ; Macdonald, A. M. ; von Salzen, K. ; Martin, R. V. ; Bertram, A. K. Refractory Black Carbon At The Whistler Peak High Elevation Research Site - Measurements And Simulations. ATMOSPHERIC ENVIRONMENT 2018, 181, 34-46.
Verhaven, A. ; Doneux, T. ; Bizzotto, D. Application Of Fret Microscopy To The Study Of The Local Environment And Dynamics Of Dna Sams On Au Electrodes. Langmuir 2018, acs.langmuir.8b02131.
Vargas–Hernández, R. A. ; Krems, R. V. Quantum Walks Assisted By Particle-Number Fluctuations. Phys. Rev. A 2018, 98, 022107.
Chong, D. P. Computational Study Of Polarizability Anisotropies. Canadian Journal of Chemistry 2018, 96, 934-938.
Smirnova, I. ; Kasho, V. ; Jiang, X. ; Chen, H. - M. ; Withers, S. G. ; H Kaback, R. Oversized Galactosides As A Probe For Conformational Dynamics In Lacy. Proceedings of the National Academy of Sciences 2018, 115, 4146–4151.
Lovering, K. A. ; Chou, K. C. Insights Into Ice Formation Via Immersion Freezing From Nonlinear Optical Spectroscopy. Topics in Catalysis 2018, 61, 1163-1168.
Dettelbach, K. E. ; Salvatore, D. A. ; Bottomley, A. ; Berlinguette, C. P. Tracking Precursor Degradation During The Photo-Induced Formation Of Amorphous Metal Oxide Films. J. Mater. Chem. A 2018, 6, 4544-4549.
Jung, H. - J. ; Chang, C. ; Yu, I. ; Aluthge, D. C. ; Ebrahimi, T. ; Mehrkhodavandi, P. Coupling Of Epoxides And Lactones By Cationic Indium Catalysts To Form Functionalized Spiro-Orthoesters. CHEMCATCHEM 2018, 10, 3219-3222.
Cantin, J. T. ; Xu, T. ; Krems, R. V. Effect Of The Anisotropy Of Long-Range Hopping On Localization In Three-Dimensional Lattices. Phys. Rev. B 2018, 98, 014204.
Dai, Y. ; Kumar, V. Pavan; Zhu, C. ; MacLachlan, M. J. ; Smith, K. J. ; Wolf, M. O. Mesoporous Silica-Supported Nanostructured Pdo/ceo2 Catalysts For Low-Temperature Methane Oxidation. ACS Applied Materials & Interfaces 2018.
Bizzotto, D. ; Burgess, I. J. ; Doneux, T. ; Sagara, T. ; Yu, H. Zhong Beyond Simple Cartoons: Challenges In Characterizing Electrochemical Biosensor Interfaces. ACS Sensors 2018, 3, 5-12.
Mafi, A. ; Abbina, S. ; Kalathottukaren, M. T. ; Morrissey, J. H. ; Haynes, C. ; Kizhakkedathu, J. N. ; Pfaendtner, J. ; Chou, K. C. Design Of Polyphosphate Inhibitors: A Molecular Dynamics Investigation On Polyethylene Glycol-Linked Cationic Binding Groups. Biomacromolecules 2018, 19, 1358-1367.
Piechota, E. J. ; Troian-Gautier, L. ; Sampaio, R. N. ; M. Brennaman, K. ; Hu, K. ; Berlinguette, C. P. ; Meyer, G. J. Optical Intramolecular Electron Transfer In Opposite Directions Through The Same Bridge That Follows Different Pathways. Journal of the American Chemical Society 2018, 140, 7176–7186.
Chile, L. - E. ; Kaser, S. J. ; Hatzikiriakos, S. G. ; Mehrkhodavandi, P. Synthesis And Thermorheological Analysis Of Biobased Lignin-Graft-Poly(Lactide) Copolymers And Their Blends. ACS SUSTAINABLE CHEMISTRY & ENGINEERING 2018, 6, 1650-1661.
Fuchs, S. ; Bennett, R. ; Krems, R. V. ; Buhmann, S. Yoshi Nonadditivity Of Optical And Casimir-Polder Potentials. Phys. Rev. Lett. 2018, 121, 083603.
Liang, Q. ; Cui, S. ; Xu, S. ; Yao, C. ; MacLachlan, M. J. ; Li, Z. A Porous Triptycene-Based Covalent Polymer Stabilized Binary Metal Sulfide For Enhanced Hydrogen Evolution Under Visible Light. Chemical Communications 2018.
Si, M. ; Irish, V. E. ; Mason, R. H. ; Vergara-Temprado, J. ; Hanna, S. J. ; Ladino, L. A. ; Yakobi-Hancock, J. D. ; Schiller, C. L. ; Wentzell, J. J. B. ; Abbatt, J. P. D. ; Carslaw, K. S. ; Murray, B. J. ; Bertram, A. K. Ice-Nucleating Ability Of Aerosol Particles And Possible Sources At Three Coastal Marine Sites. ATMOSPHERIC CHEMISTRY AND PHYSICS 2018, 18, 15669-15685.
Leung, K. K. ; Gaxiola, A. Diaz; Yu, H. Zhong; Bizzotto, D. Tailoring The Dna Sam Surface Density On Different Surface Crystallographic Features Using Potential Assisted Thiol Exchange. Electrochimica Acta 2018, 261, 188–197.
Burford, R. J. ; Castro, L. ; Maron, L. ; Hein, J. E. ; Fryzuk, M. D. Dinitrogen Functionalization At A Ditantalum Center. Balancing N-2 Displacement And N-2 Functionalization In The Reaction Of Coordinated N-2 With Cs2. DALTON TRANSACTIONS 2018, 47, 7983-7991.
Wang, L. ; Bo, T. ; Zhang, Z. ; Wang, G. ; Tong, W. ; Chen, D. Da Yong High Resolution Capillary Isoelectric Focusing Mass Spectrometry Analysis Of Peptides, Proteins, And Monoclonal Antibodies With A Flow-Through Microvial Interface. Analytical Chemistry 2018, 90, in-press.
Sampaio, R. N. ; Piechota, E. J. ; Troian-Gautier, L. ; Maurer, A. B. ; Hu, K. ; Schauer, P. A. ; Blair, A. D. ; Berlinguette, C. P. ; Meyer, G. J. Kinetics Teach That Electronic Coupling Lowers The Free-Energy Change That Accompanies Electron Transfer. Proceedings of the National Academy of Sciences 2018, 115, 7248–7253.
Huang, J. ; Liu, S. ; Zhang, D. H. ; Krems, R. V. Time-Dependent Wave Packet Dynamics Calculations Of Cross Sections For Ultracold Scattering Of Molecules. Phys. Rev. Lett. 2018, 120, 143401.
Xu, Y. - T. ; Dai, Y. ; Nguyen, T. - D. ; Hamad, W. Y. ; MacLachlan, M. J. Aerogel Materials With Periodic Structures Imprinted With Cellulose Nanocrystals. Nanoscale 2018.
DeMott, P. J. ; Mason, R. H. ; McCluskey, C. S. ; Hill, T. C. J. ; Perkins, R. J. ; Desyaterik, Y. ; Bertram, A. K. ; Trueblood, J. V. ; Grassian, V. H. ; Qiu, Y. ; Molinero, V. ; Tobo, Y. ; Sultana, C. M. ; Lee, C. ; Prather, K. A. Ice Nucleation By Particles Containing Long-Chain Fatty Acids Of Relevance To Freezing By Sea Spray Aerosols. ENVIRONMENTAL SCIENCE: PROCESSES & IMPACTS 2018, 20, 1559-1569.
Wang, J. ; Zhou, Y. ; Wang, M. ; Bi, W. ; Li, H. ; Chen, D. Da Yong High-Throughput Analysis For Artemisinins With Deep Eutectic Solvents Mechanochemical Extraction And Direct Analysis In Real Time Mass Spectrometry. Analytical Chemistry 2018, 90 (5), pp , 3109–3117.
Hedges, J. B. ; Kuatsjah, E. ; Du, Y. - L. ; Eltis, L. D. ; Ryan, K. S. Snapshots Of The Catalytic Cycle Of An O2, Pyridoxal Phosphate-Dependent Hydroxylase. ACS Chemical Biology 2018, In Press.
Dehn, M. H. ; Arseneau, D. J. ; Buck, T. ; Cortie, D. L. ; Fleming, D. G. ; King, S. R. ; MacFarlane, W. A. ; McDonagh, A. M. ; McFadden, R. M. L. ; Mitchell, D. R. G. ; , Nature Of Magnetism In Thiol-Capped Gold Nanoparticles Investigated With Muon Spin Rotation. Applied Physics Letters 2018, 112, 053105.
Kodros, J. K. ; Hanna, S. J. ; Bertram, A. K. ; Leaitch, W. R. ; Schulz, H. ; Herber, A. B. ; Zanatta, M. ; Burkart, J. ; Willis, M. D. ; Abbatt, J. P. D. ; Pierce, J. R. Size-Resolved Mixing State Of Black Carbon In The Canadian High Arctic And Implications For Simulated Direct Radiative Effect. ATMOSPHERIC CHEMISTRY AND PHYSICS 2018, 18, 11345-11361.
Kamath, A. ; Vargas-Hernández, R. A. ; Krems, R. V. ; Carrington, T. ; Manzhos, S. Neural Networks Vs Gaussian Process Regression For Representing Potential Energy Surfaces: A Comparative Study Of Fit Quality And Vibrational Spectrum Accuracy. J. Chem. Phys. 2018, 148, 241702.
Nguyen, T. - D. ; Hamad, W. Y. ; MacLachlan, M. J. Aerogel Templating On Functionalized Fibers Of Nanocellulose Networks. Materials Chemistry Frontiers 2018.
Ma, H. ; Zhang, K. ; Jiang, Q. ; Dai, D. ; Li, H. ; Bi, W. ; Chen, D. Da Yong Characterization Of Plant Polysaccharides From Dendrobium Officinale By Multiple Chromatographic And Mass Spectrometric Techniques. Journal of Chromatography A 2018, 1547, 29 - 36.