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

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

(2009) Adolfo Bastida et al.   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

IR and Raman spectra of liquid water: Theory and interpretation

(2008) B. M. Auer et al.   JOURNAL OF CHEMICAL PHYSICS

Vibrational Energy Relaxation of the Bend Fundamental of Dilute Water in Liquid Chloroform andd-Chloroform†

(2007) Y.-S. Lin et al.   JOURNAL OF PHYSICAL CHEMISTRY B