| 1 |
Molecular-Level Mechanisms of Vibrational Frequency Shifts in a Polar Liquid
Morales CM, Thompson WH
Journal of Physical Chemistry B, 115(23), 7597, 2011 |
| 2 |
Electronic Structural Comparison of the Reactions of Dioxygen and Alkenes with Nitrogen-Chelated Palladium(0)
Popp BV, Morales CM, Landis CR, Stahl SS
Inorganic Chemistry, 49(18), 8200, 2010 |
| 3 |
Simulations of Infrared Spectra of Nanoconfined Liquids: Acetonitrile Confined in Nanoscale, Hydrophilic Silica Pores
Morales CM, Thompson WH
Journal of Physical Chemistry A, 113(10), 1922, 2009 |
| 4 |
Umbrella sampling of solute vibrational line shifts in mixed quantum-classical molecular dynamics Simulations
Morales CM, Thompson WH
Journal of Physical Chemistry B, 112(2), 313, 2008 |
| 5 |
Mixed quantum-classical molecular dynamics analysis of the molecular-level mechanisms of vibrational frequency shifts
Morales CM, Thompson WH
Journal of Physical Chemistry A, 111(25), 5422, 2007 |
| 6 |
"Inverse-electron-demand" ligand substitution: Experimental and computational insights into olefin exchange at palladium(0)
Popp BV, Thorman JL, Morales CM, Landis CR, Stahl SS
Journal of the American Chemical Society, 126(45), 14832, 2004 |
| 7 |
Insights into the spin-forbidden reaction between L2Pd0 and molecular oxygen
Landis CR, Morales CM, Stahl SS
Journal of the American Chemical Society, 126(50), 16302, 2004 |
