Publications

Scholz SO, Farney EP, Kim S, Bates DM, Yoon TP. Spin-Selective Generation of Triplet Nitrenes: Olefin Aziridination through Visible-Light Photosensitization of Azidoformates. Angewandte Chemie-International Edition. 2016;55:2239-2242.
Blum TR, Miller ZD, Bates DM, Guzei IA, Yoon TP. Enantioselective photochemistry through Lewis acid-catalyzed triplet energy transfer. Science. 2016;354:1391-1395.
Ng JD, Upadhyay SP, Marquard AN, Lupo KM, Hinton DA, Padilla NA, et al.. Single-Molecule Investigation of Initiation Dynamics of an Organometallic Catalyst. Journal of the American Chemical Society. 2016;138:3876-3883.
Van Hoveln R, Hudson BM, Wedler HB, Bates DM, Le Gros G, Tantillo DJ, et al.. Mechanistic Studies of Copper(I)-Catalyzed 1,3-Halogen Migration. Journal of the American Chemical Society. 2015;137:5346-5354.
Upadhyay SP, Lupo KM, Marquard AN, Ng JD, Bates DM, Goldsmith RH. Fluorescent Dendrimeric Molecular Catalysts Demonstrate Unusual Scaling Behavior at the Single-Molecule Level. Journal of Physical Chemistry C. 2015;119:19703-19714.
Bates DM, Smith JR, Janowski T, Tschumper GS. Development of a 3-body: many-body integrated fragmentation method for weakly bound clusters and application to water clusters (H2O)(n=3)-10, 16, 17. Journal of Chemical Physics. 2011;135.
Bates DM, Smith JR, Tschumper GS. Efficient and Accurate Methods for the Geometry Optimization of Water Clusters: Application of Analytic Gradients for the Two-Body:Many-Body QM:QM Fragmentation Method to (H2O)n, n = 3–10. Journal of Chemical Theory and Computation [Internet]. 2011;7:2753-2760. http://dx.doi.org/10.1021/ct200176t
Bates DM, Tschumper GS. CCSD(T) Complete Basis Set Limit Relative Energies for Low-Lying Water Hexamer Structures. The Journal of Physical Chemistry A [Internet]. 2009;113:3555-3559. http://dx.doi.org/10.1021/jp8105919
Bates DM, Anderson JA, Oloyede P, Tschumper GS. Probing the effects of heterogeneity on delocalized π..π interaction energies. Phys. Chem. Chem. Phys. [Internet]. 2008;10:2775-2779. http://dx.doi.org/10.1039/B718720C