| 1 |
Reaction Mechanism for Direct Proton Transfer from Carbonic Acid to a Strong Base in Aqueous Solution I: Acid and Base Coordinate and Charge Dynamics
Daschakraborty S, Kiefer PM, Miller Y, Motro Y, Pines D, Pines E, Hynes JT
Journal of Physical Chemistry B, 120(9), 2271, 2016 |
| 2 |
Reaction Mechanism for Direct Proton Transfer from Carbonic Acid to a Strong Base in Aqueous Solution II: Solvent Coordinate-Dependent Reaction Path
Daschakraborty S, Kiefer PM, Miller Y, Motro Y, Pines D, Pines E, Hynes JT
Journal of Physical Chemistry B, 120(9), 2281, 2016 |
| 3 |
How Acidic Is Carbonic Acid?
Pines D, Ditkovich J, Mukra T, Miller Y, Kiefer PM, Daschakraborty S, Hynes JT, Pines E
Journal of Physical Chemistry B, 120(9), 2440, 2016 |
| 4 |
Effect of Solvent Dielectric Constant and Acidity on the OH Vibration Frequency in Hydrogen-Bonded Complexes of Fluorinated Ethanols
Pines D, Keinan S, Kiefer PM, Hynes JT, Pines E
Journal of Physical Chemistry B, 119(29), 9278, 2015 |
| 5 |
Solvent-Induced Red-Shifts for the Proton Stretch Vibrational Frequency in a Hydrogen-Bonded Complex. 1. A Valence Bond-Based Theoretical Approach
Kiefer PM, Pines E, Pines D, Hynes JT
Journal of Physical Chemistry B, 118(28), 8330, 2014 |
| 6 |
Kinetic isotope effects for nonadiabatic proton transfer reactions in a polar environment. 1. Interpretation of tunneling kinetic isotopic effects
Kiefer PM, Hynes JT
Journal of Physical Chemistry A, 108(52), 11793, 2004 |
| 7 |
Kinetic isotope effects for nonadiabatic proton transfer reactions in a polar environment. 2. Comparison with an electronically diabatic description
Kiefer PM, Hynes JT
Journal of Physical Chemistry A, 108(52), 11809, 2004 |
| 8 |
Adiabatic and nonadiabatic proton transfer rate constants in solution
Kiefer PM, Hynes JT
Solid State Ionics, 168(3-4), 219, 2004 |
| 9 |
Kinetic isotope effects for adiabatic proton transfer reactions in a polar environment
Kiefer PM, Hynes JT
Journal of Physical Chemistry A, 107(42), 9022, 2003 |
| 10 |
Nonlinear free energy relations for adiabatic proton transfer reactions in a polar environment. I. Fixed proton donor-acceptor separation
Kiefer PM, Hynes JT
Journal of Physical Chemistry A, 106(9), 1834, 2002 |
