Publications
Under review:
- L. F. L. Oliveira, “Strategies for E ffective Utilization of Writing and Educational YouTube Videos in the Context of General Chemistry Topics.”
- Jerhett Morehouse, Alyssa McPhee, Emily Howie, L. F. L. Oliveira, “Gold Nanocluster-Amino acid Interactions: Assessment of DFTB with Dispersion Corrections.”
Published:
- M. Jora, D. Corcoran, G. Parungao, P. Lobue, L. F. L. Oliveira, G. Stan, B. Addepalli, P. Limbach “Higher-Energy Collision Dissociation Mass Spectral Networks for the Rapid, Semi-automated Characterization of Known and Unknown Ribonucleoside” Analytical Chemistry (2022), 94, 40, 13958.
- H. Y. Fonseka, A. Javidi, L. F. L. Oliveira, C. Micheletti, and G. Stan. “Unfolding and translocation of knotted proteins by Clp biological nanomachines: synergistic contribution of primary sequence and topology revealed by molecular dynamics simulations” J. Phys. Chem. B (2021), 125, 27, 7335.
- K. S. Sykes, L. F. L. Oliveira, G. Stan, and R. J. White “Electrochemical Studies of Cation Condensation-Induced Collapse of Surface-Bound DNA” Langmuir (2019), 35, 40, 12962.
- L. F. L. Oliveira, C. D. Fu, and J. Pfaendtner. “Density Functional Tight-Binding and Infrequent Metadynamics can Capture Entropic Effects in Intramolecular Hydrogen Transfer Reactions” J. Chem. Phys. (2018), 148, 154101.
- C. D. Fu, L. F. L. Oliveira, and J. Pfaendtner. “Assessing Generic Collective Variables for Determining Reaction Rates in Metadynamics Simulations” J. Chem. Theory Comput. (2017), 13 (3), 968.
- C. D. Fu, L. F. L. Oliveira, and J. Pfaendtner. “Determining Energy Barriers and Selectivities of a Multi-Pathway System With Infrequent Metadynamics” J. Chem. Physics (2017), 146 014108.
- L. F. L. Oliveira, N. Tarrat, J. Cuny, J. Morillo, D. Lemoine, F. Spiegelman, and M. Rapacioli. “Benchmarking Density Functional Based Tight-Binding for Silver and Gold Materials: From Small Clusters to Bulk.” J. Phys. Chem. A (2016), 120 (42), 8469.
- L. F. L. Oliveira, J. Cuny, M. Moriniere, L. Dontot, A. Simon, F. Spiegelman, and M. Rapacioli. “Phase Changes of the Water Hexamer and Octamer in the Gas Phase and Adsorbed on Polycyclic Aromatic Hydrocarbons.” Phys. Chem. Chem. Phys., (2015), 17, 17079.
- L. F. L. Oliveira, C. Jallut, and A. A. Franco. “A Multiscale Physical Model of a Polymer Electrolyte Membrane Water Electrolyzer.” Electrochimica Acta, (2013), 110, 363.
- L. F. L. Oliveira, E. Mayousse, C. Jallut, and A. A. Franco. “A Multiscale Physical Model for the Transient Analysis of PEM Water Electrolyzer Anodes.” Phys. Chem. Chem. Phys., (2012), 14, 10215.