Modeling the intermolecular interactions and characterization of the dynamics of collisional autoionization processes

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Abstract

The autoionization dynamics of triatomic molecules induced by He *(23,1S1,0) and Ne *(3P2,0) collisions has been discussed. The systems are analyzed by using an optical potential model within a semiclassical approach. The real part of the potential is formulated applying a semiempirical method, while the imaginary part has been used in the fitting procedure of the data adjusting its pre-exponential factor. The good agreement between calculations and experiment confirms the attractive nature of the potential energy surface driving the He* and Ne *-H2O dynamics. © 2013 Springer-Verlag Berlin Heidelberg.

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Falcinelli, S., Rosi, M., Candori, P., Vecchiocattivi, F., Bartocci, A., Lombardi, A., … Pirani, F. (2013). Modeling the intermolecular interactions and characterization of the dynamics of collisional autoionization processes. In Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) (Vol. 7971 LNCS, pp. 69–83). Springer Verlag. https://doi.org/10.1007/978-3-642-39637-3_6

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