1 |
Solvent effects on structure and reaction mechanism : A theoretical study of [2+2] polar cycloaddition between ketene and imine Truong TN Journal of Physical Chemistry B, 102(40), 7877, 1998 |
2 |
A General Methodology for Quantum Modeling of Free-Energy Profile of Reactions in Solution - An Application to the Menshutkin Nh3+ch3Cl Reaction in Water Truong TN, Truong TT, Stefanovich EV Journal of Chemical Physics, 107(6), 1881, 1997 |
3 |
Study of the Ag+ Hydration by Means of a Semicontinuum Quantum-Chemical Solvation Model Martinez JM, Pappalardo RR, Marcos ES Journal of Physical Chemistry A, 101(24), 4444, 1997 |
4 |
Self-Consistent-Field Calculation of Pauli Repulsion and Dispersion Contributions to the Solvation Free-Energy in the Polarizable Continuum Model Amovilli C, Mennucci B Journal of Physical Chemistry B, 101(6), 1051, 1997 |
5 |
Development and Validation of Reliable Quantum-Mechanical Approaches for the Study of Free-Radicals in Solution Rega N, Cossi M, Barone V Journal of Chemical Physics, 105(24), 11060, 1996 |
6 |
Molecular-Interactions in Solution - An Overview of Methods Based on Continuous Distributions of the Solvent Tomasi J, Persico M Chemical Reviews, 94(7), 2027, 1994 |