Ab initio simulations of confined molecular systems and photodissociation dynamics
The Multiscale Ab-initio Modelling unit led by M. P. de Lara-Castells is aimed at the fundamental understanding, prediction, control, and modification of the properties and behaviour of molecular systems under different confinement environments towards useful applications in industry.
The Photodissociation Dynamics unit led by A. García Vela aims at studying theoretically the dynamics of photodissociation processes in molecules and molecular clusters, using mainly quantum mechanical methods. One of the main goals of the research developed is the control of such processes by applying external laser fields. Collaboration with experimental groups in the field is actively pursued.
María Pilar de Lara Castells
Alberto García Vela
Patricia López Caballero (graduated student under the Garantía Juvenil program)
Alfredo Serrano Jimenez (graduated student under the Garantía Juvenil program)