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Abstract:

New insights into equilibrium and dynamical aspects of electron photodetachment reactions in small water clusters were given. It focuses on assessing the effects of thermal and polarization fluctuations provided by three cluster environments with different extents of spatial confinement, on the microscopic mechanisms that drive the reaction. These fluctuations, in turn, determine the characteristics of the electron localization and the subsequent detachment following photoexcitation of the probe.

Registro:

Documento: Artículo
Título:Solvation dynamics following electron photodetachment from l- in aqueous clusters
Autor:Elola, M.D.; Laria, D.
Filiación:Departamento de Quimica Inorganica, Analitica y Quimica-Fisica e INQUIMAE, Facultad de Ciencias Exactas y Naturales, Pabellón II, 1428, Buenos Aires, Argentina
Unidad Actividad Química, Comisión Nacional de Energía Atómica, Avenida Libertador 8250, 1429, Buenos Aires, Argentina
Palabras clave:Algorithms; Chemical relaxation; Diffusion; Electronic properties; Ground state; Mathematical models; Molecular structure; Photochemical reactions; Quantum theory; Solutions; Diffuse density profile; Electron photodetachment; Electronic excitation; Equilibrium solvation structures; Solvation dynamics; Surface states; Molecular dynamics
Año:2002
Volumen:117
Número:5
Página de inicio:2238
Página de fin:2245
DOI: http://dx.doi.org/10.1063/1.1489896
Título revista:Journal of Chemical Physics
Título revista abreviado:J Chem Phys
ISSN:00219606
CODEN:JCPSA
PDF:https://bibliotecadigital.exactas.uba.ar/download/paper/paper_00219606_v117_n5_p2238_Elola.pdf
Registro:https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00219606_v117_n5_p2238_Elola

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Citas:

---------- APA ----------
Elola, M.D. & Laria, D. (2002) . Solvation dynamics following electron photodetachment from l- in aqueous clusters. Journal of Chemical Physics, 117(5), 2238-2245.
http://dx.doi.org/10.1063/1.1489896
---------- CHICAGO ----------
Elola, M.D., Laria, D. "Solvation dynamics following electron photodetachment from l- in aqueous clusters" . Journal of Chemical Physics 117, no. 5 (2002) : 2238-2245.
http://dx.doi.org/10.1063/1.1489896
---------- MLA ----------
Elola, M.D., Laria, D. "Solvation dynamics following electron photodetachment from l- in aqueous clusters" . Journal of Chemical Physics, vol. 117, no. 5, 2002, pp. 2238-2245.
http://dx.doi.org/10.1063/1.1489896
---------- VANCOUVER ----------
Elola, M.D., Laria, D. Solvation dynamics following electron photodetachment from l- in aqueous clusters. J Chem Phys. 2002;117(5):2238-2245.
http://dx.doi.org/10.1063/1.1489896