Skip to content

You are here: Home / Members / elvira.guardia / Publications / 2000-2004

2000-2004

48.- “ On the solvation shell of Na+ and Cl- ions in acetonitrile: A computer simulation study”

E. Guàrdia, R.Pinzón
Journal of Molecular Liquids 85, 33-44 (2000)

49.- “Dielectric properties of  liquid ethanol: A computer simulation study"

L. Saiz, E.Guàrdia, J.A.Padró
Journal of Chemical Physics 113, 2814-2822 (2000)

50.-“Molecular dynamics simulation of the structure of water in a wide temperature range”

A.V.Egorov, A.V. Komolkin, V.I.Chizhik, J.A.Padró, E.Guàrdia
Russian Journal of Physical Chemistry 74, 1650-1654 (2000)

51.- “Comparison of different three site interaction potentials for liquid acetonitrile“

E.Guàrdia, R.Pinzón, J.Casulleras, M.Orozco, F.J. Luque
Molecular Simulation 26, 287-306 (2001)

52.- "Structure of liquid ethylene glycol: A Molecular Dynamics simulation study with different force fields"

L. Saiz, J.A.Padró, E.Guàrdia
Journal of Chemical Physics 114, 3187-3199 (2001)

53.- "Dynamics in hydrogen bonded liquids: water and alcohols"

E. Guàrdia, J. Martí, J. A. Padró, L. Saiz, A. V. Komolkin
Journal of Molecular Liquids 96, 3-17 (2002)

54.- "Density dependence of reorientational motions in supercritical water"

E. Guàrdia, J. Martí
Journal of Molecular Liquids 101, 137-147 (2002)

55.- “Reorientational motions in sub- and supercritical water under extreme confinement”

J. Martí, E. Guàrdia, M. C. Gordillo
Chemical Physics Letters 365, 536-541 (2002)

56.- “Density and temperature effects on the orientational and dielectric properties of supercritical water”

E. Guàrdia, J. Martí
Physical Review E 69, 011502/1-11 (2004)

57.- “Protons in supercritical water: a multistate empirical valence bond study”

D. Laria, J. Martí, E. Guàrdia
Journal of the American Chemical Society 126, 2125-2134 (2004)