| 1 |
Direct-Dynamics VTST Study of the [1,7] Hydrogen Shift in 7-Methylocta-1,3-(Z),5(Z)-triene. A Model System for the Hydrogen Transfer Reaction in Previtamin D-3 (vol 111, pg 719, 2007)
Mousavipour SH, Fernandez-Ramoss A, Meana-Paneda R, Martinez-Nunez E, Vazquez SA, Rios MA
Journal of Physical Chemistry A, 115(33), 9322, 2011 |
| 2 |
Solvent-Modulated Ground-State Rotamerism and Tautomerism and Excited-State Proton-Transfer Processes in o-Hydroxynaphthylbenzimidazoles
Brenlla A, Rodriguez-Prieto F, Mosquera M, Rios MA, Rodriguez MCR
Journal of Physical Chemistry A, 113(1), 56, 2009 |
| 3 |
Direct-dynamics VTST study of the [1,7] hydrogen shift in 7-methylocta-1,3(Z),5(Z)-triene. A model system for the hydrogen transfer reaction in previtamin D-3
Mousavipour SH, Fernandez-Ramos A, Meana-Paneda R, Martinez-Nunez E, Vazquez SA, Rios MA
Journal of Physical Chemistry A, 111(4), 719, 2007 |
| 4 |
Hydrogen transfer vs proton transfer in 7-hydroxy-quinoline center dot(NH3)(3): A CASSCF/CASPT2 study
Fernandez-Ramos A, Martinez-Nunez E, Vazquez SA, Rios MA, Estevez CM, Merchan M, Serrano-Andres L
Journal of Physical Chemistry A, 111(26), 5907, 2007 |
| 5 |
Rate constants and kinetic isotope effects for Cl+CH4 -> ClH+CH3: a comparison between LSC-IVR and statistical theories
Martinez-Nunez E, Fernandez-Ramos A, Vazquez SA, Rios MA
Chemical Physics Letters, 360(1-2), 59, 2002 |
| 6 |
Ab initio study of interactions in methylamine clusters. The significance of cooperative effects
Cabaleiro-Lago EM, Rios MA
Journal of Chemical Physics, 112(5), 2155, 2000 |
| 7 |
An ab initio study of the interaction in dimethylamine dimer and trimer
Cabaleiro-Lago EM, Rios MA
Journal of Chemical Physics, 113(21), 9523, 2000 |
| 8 |
Development of an intermolecular potential function for interactions in formamide clusters based on ab initio calculations
Cabaleiro-Lago EM, Rios MA
Journal of Chemical Physics, 110(14), 6782, 1999 |
| 9 |
Ab initio study of interactions in hydrazine clusters of one to four molecules: Cooperativity in the interaction
Cabaleiro-Lago EM, Rios MA
Journal of Physical Chemistry A, 103(32), 6468, 1999 |
| 10 |
Direct-dynamics approaches to proton tunneling rate constants. A comparative test for molecular inversions and an application to 7-azaindole tautomerization
Fernandez-Ramos A, Smedarchina Z, Siebrand W, Zgierski MZ, Rios MA
Journal of the American Chemical Society, 121(26), 6280, 1999 |
