Molecular dynamics with quantum transitions study of the vibrational relaxation of the HOD bend fundamental in liquid D2O

Temperature dependence of vibrational relaxation of the OH bending excitation in liquid H2O

(2010) Satoshi Ashihara et al.   CHEMICAL PHYSICS LETTERS

Hydrogen Bond Rearrangements in Water Probed with Temperature-Dependent 2D IR

(2010) Rebecca A. Nicodemus et al.   Journal of Physical Chemistry Letters

Efficient parabolic evaluation of coupling terms in hybrid quantum/classical simulations

(2009) Adolfo Bastida et al.   CHEMICAL PHYSICS

Reorientation of HDO in liquid H2O at different temperatures: Comparison of first and second order correlation functions

(2009) K.J. Tielrooij et al.   CHEMICAL PHYSICS LETTERS

OD stretch vibrational relaxation of HOD in liquid to supercritical H2O

(2009) Tim Schäfer et al.   JOURNAL OF CHEMICAL PHYSICS

Hybrid quantum/classical simulation of the vibrational relaxation of the bend fundamental in liquid water

(2009) Adolfo Bastida et al.   JOURNAL OF CHEMICAL PHYSICS

Nonequilibrium molecular dynamics simulations of vibrational energy relaxation of HOD in D2O

(2009) Alexander Kandratsenka et al.   JOURNAL OF CHEMICAL PHYSICS

Ultrafast Energy Transfer from the Intramolecular Bending Vibration to Librations in Liquid Water

(2009) Francesca Ingrosso et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Pathways for H2O Bend Vibrational Relaxation in Liquid Water

(2009) Rossend Rey et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Full quantum vibrational simulation of the relaxation of the cyanide ion in water using the Ehrenfest method with quantum corrections

(2008) Adolfo Bastida et al.   JOURNAL OF CHEMICAL PHYSICS