| 1 |
Cycloaddition of carbonyl compounds on Si(100): New mechanisms and approaches to selectivity for surface cycloaddition reactions
Barriocanal JA, Doren DJ
Journal of the American Chemical Society, 123(30), 7340, 2001 |
| 2 |
Exploring the ab initio/classical free energy perturbation method: The hydration free energy of water
Sakane S, Yezdimer EM, Liu WB, Barriocanal JA, Doren DJ, Wood RH
Journal of Chemical Physics, 113(7), 2583, 2000 |
| 3 |
Reactions of nitromethane on Si(100): First-principles predictions
Barriocanal JA, Doren DJ
Journal of Physical Chemistry B, 104(51), 12269, 2000 |
| 4 |
1,3-dipolar cycloadditions on Si(100)-2x1: Theoretical studies of novel attachment chemistry for organic monolayers
Barriocanal JA, Doren DJ
Journal of Vacuum Science & Technology A, 18(4), 1959, 2000 |
| 5 |
Free energies of solvation with quantum mechanical interaction energies from classical mechanical simulations
Wood RH, Yezdimer EM, Sakane S, Barriocanal JA, Doren DJ
Journal of Chemical Physics, 110(3), 1329, 1999 |
