D2 +Nin(T), n=7 and 9, Collision System

Böyükata, Mustafa; Durmuş, Perihan; Özçelik, Süleyman; Güvenç, Ziya B.; Jellinek, Julius

doi:10.3390/mca4010061

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Article

1 April 1999

7 Pages

D2 +Nin(T), n=7 and 9, Collision System

and

Department of Physics, Gazi University, 06500 Ankara, Turkey

Department of Computer Engineering, Çankaya University, 06530 Ankara, Turkey

Chemistry Division, Argonne National Laboratory, Argonne, IL 60439, USA

Authors to whom correspondence should be addressed.

Math. Comput. Appl.1999, 4(1), 61-67;https://doi.org/10.3390/mca4010061

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Abstract

In this study the kinetics of reactions of Ni_n n=7 and 9, clusters with a deuterium D₂ molecule are studied via quasiclassical molecular dynamics. Dissociative chemisorption probabilities as functions of impact parameters, collision energies, and a rovibrational state of a molecule are calculated. And the corresponding reactive cross sections are evaluated. Resonance formation in the low collision energy region is discussed.

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