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1.
Phys Chem Chem Phys ; 14(15): 5260-4, 2012 Apr 21.
Artigo em Inglês | MEDLINE | ID: mdl-22402572

RESUMO

A new type of traveling interface modulation has been observed in the NH(3) + O(2) reaction on a Rh(110) surface. A model is set up which reproduces the effect, which is attributed to diffusional mixing of two spatially separated adsorbates causing an excitability which is strictly localized to the vicinity of the interface of the adsorbate domains.


Assuntos
Amônia/química , Oxigênio/química , Ródio/química , Catálise , Modelos Teóricos , Oxirredução , Radioisótopos/química , Propriedades de Superfície
2.
Phys Rev E Stat Nonlin Soft Matter Phys ; 80(4 Pt 1): 041303, 2009 Oct.
Artigo em Inglês | MEDLINE | ID: mdl-19905304

RESUMO

A highly polydisperse granular gas is modeled by a continuous distribution of particle sizes, a , giving rise to a corresponding continuous temperature profile, T(a) , which we compute approximately, generalizing previous results for binary or multicomponent mixtures. If the system is driven, it evolves toward a stationary temperature profile, which is discussed for several driving mechanisms in dependence on the variance of the size distribution. For a uniform distribution of sizes, the stationary temperature profile is nonuniform with either hot small particles (constant force driving) or hot large particles (constant velocity or constant energy driving). Polydispersity always gives rise to non-Gaussian velocity distributions. Depending on the driving mechanism the tails can be either overpopulated or underpopulated as compared to the molecular gas. The deviations are mainly due to small particles. In the case of free cooling the decay rate depends continuously on particle size, while all partial temperatures decay according to Haff's law. The analytical results are supported by event driven simulations for a large, but discrete number of species.


Assuntos
Gases/química , Termodinâmica , Modelos Químicos , Probabilidade , Temperatura
3.
Phys Rev E Stat Nonlin Soft Matter Phys ; 78(5 Pt 2): 055203, 2008 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-19113178

RESUMO

It is shown that the pulses which develop in the NO+H2 reaction on an alkali promoted Rh(110) surface reaction can transport alkali metal. This leads to the accumulation of a substantial alkali-metal concentration in the collision area of pulse trains. Realistic simulations revealed that the effect is due to the strong energetic interactions of the alkali metal with coadsorbates, i.e., the attractive interaction with coadsorbed oxygen and the effectively repulsive interaction with coadsorbed nitrogen.

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