13. Sonnenberg, J. L.; Wong, K. F.; Voth, G. A.; Schlegel, H. B.; “Distributed Gaussian Valence Bond Surface Derived from Ab Initio Calculations,” J. Chem. Theory Comput., 2009, 5, 949-961.
12. Sonnenberg, J. L.; Hratchian, H. P.; Schlegel, H. B.; “Spin Contamination in Inorganic Chemistry Calculations” ” In Encyclopedia of Inorganic Chemistry; 3rd, Solomon, E. I., King, R. B., Scott, R. A., Eds.; John Wiley & Sons, Ltd., New York, 2009.
11. Sonnenberg, J. L.; Schlegel, H. B.; “Empirical Valence Bond Models for Reactive Potential Energy Surfaces. II. Intramolecular Proton Transfer in Pyridone and the Claisen Reaction of Allyl Vinyl Ether,” Molecular Physics, 2007, 105, 2719-2729.
10. Chaka, G.; Sonnenberg, J. L.; Schlegel, H. B.; Heeg, M. J.; Jaeger, G.; Nelson, T. J.; Ochrymowycz, L. A.; Rorabacher, D. B.; “A Definitive Example of a Geometric “Entatic State” Effect: Electron-Transfer Kinetics for a Copper(II/I) Complex Involving A Quinquedentate Macrocyclic Trithiaether−Bipyridine Ligand,” J. Am. Chem. Soc., 2007, 129, 5217-5227.
9. Seadeek, C.; Ando H.; Bhattachar, S. N.; Heimbach, T.; Sonnenberg, J. L.; Blackburn, A. C.; “Automated Approach to Couple Solubility with Final pH and Crystallinity for Pharmaceutical Discovery Compounds,” J. Pharm. Biomed. Anal., 2007, 43, 1660-1666.
8. Schlegel, H. B.; Sonnenberg, J. L.; “Empirical Valence Bond Models for Reactive Potential Energy Surfaces Using Distributed Gaussians,” J. Chem. Theory Comput., 2006, 2, 905-911.
7. Bursten, B. E.; Palmer, E. J.; Sonnenberg, J. L. “On the Role of f-orbitals in the Bonding in f-element Complexes: The “FEUDAL” Model as Applied to Organoactinide and Actinide Aquo Complexes,” Recent Advances in Actinide Science, R. Alvares, N. Bryan and I. May, Ed.; Royal Society of Chemistry 2006, 157-162.
6. Sonnenberg, J. L.; “Structure and Reactivity Studies of Environmentally Relevant Actinide-Containing Species Using Relativistic Density Functional Theory,” Ph.D. Thesis, Ohio State University, 2005.
5. Hratchian, H. P.; Sonnenberg, J. L.; Hay, P. J.; Martin, R. L.; Bursten, B. E.; Schlegel, H. B. “Theoretical Investigation of Uranyl Dihydroxide: Oxo Ligand Exchange, Water Catalysis, and Vibrational Spectra,” J. Phys. Chem. A., 2005, 109, 8579-8586.
4. Sonnenberg, J. L.; Hay, P. J.; Martin, R. L.; Bursten, B. E. “Theoretical Investigations of Uranyl-ligand Bonding: Four- and Five-coordinate Uranyl Cyanide, Isocyanide, Carbonyl, and Hydroxide Complexes,” Inorg. Chem., 2005, 44, 2255-2262.
3. Clark, A. E.; Sonnenberg, J. L.; Hay, P. J.; Martin, R. L. “Density and Wave Function Analysis of Actinide Complexes: What can Fuzzy Atom, Atoms-in-molecules, Mulliken, Löwdin, and Natural Population Analysis Tell Us?” J. Chem. Phys., 2004, 121, 2563-2570.
2. Neu, M. P.; Sonnenberg, J. L.; Bursten, B. E.; “Classic High-symmetry Species That Advance Our Understanding of f-element Structure, Bonding, and Dynamics,” Actinide Res. Quart., 2004, 1, 7-10.
1. Sonnenberg, J. L.; Milletti M. C. “Ab Initio Investigation of the Synthesis of (3 (2,3,4,5
Tetramethylcyclopentadienyl)propoxy)titanium Dichloride,” Polyhedron, 2002, 21, 2699-2704.
