Ágnes Vibók

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This study investigates the effect of chemical substituents on the functional properties of a molecular photoswitch (Phys. Chem. Chem. Phys., 2008, 10, 1243) by means of theoretical tools. Molecular switches are known to consist of so-called frame and crane components. Several functional groups are substituted to the 7-hydroxyquinoline molecular frame at(More)
Recently we reported a series of numerical simulations proving that it is possible in principle to create an electronic wave packet and subsequent electronic motion in a neutral molecule photoexcited by a UV pump pulse within a few femtoseconds. We considered the ozone molecule: for this system the electronic wave packet leads to a dissociation process. In(More)
The present theoretical study is concerned with the vibrational trapping or bond hardening, which is a well-known phenomenon predicted by a dressed state representation of small molecules like and in an intense laser field. This phenomenon is associated with a condition where the energy of the light induced, vibrational level coincides with one of the(More)
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