scholarly journals Fast Reaction Limits via $$\Gamma $$-Convergence of the Flux Rate Functional

Author(s):  
Mark A. Peletier ◽  
D. R. Michiel Renger

AbstractWe study the convergence of a sequence of evolution equations for measures supported on the nodes of a graph. The evolution equations themselves can be interpreted as the forward Kolmogorov equations of Markov jump processes, or equivalently as the equations for the concentrations in a network of linear reactions. The jump rates or reaction rates are divided in two classes; ‘slow’ rates are constant, and ‘fast’ rates are scaled as $$1/\epsilon $$ 1 / ϵ , and we prove the convergence in the fast-reaction limit $$\epsilon \rightarrow 0$$ ϵ → 0 . We establish a $$\Gamma $$ Γ -convergence result for the rate functional in terms of both the concentration at each node and the flux over each edge (the level-2.5 rate function). The limiting system is again described by a functional, and characterises both fast and slow fluxes in the system. This method of proof has three advantages. First, no condition of detailed balance is required. Secondly, the formulation in terms of concentration and flux leads to a short and simple proof of the $$\Gamma $$ Γ -convergence; the price to pay is a more involved compactness proof. Finally, the method of proof deals with approximate solutions, for which the functional is not zero but small, without any changes.

Author(s):  
Mark A. Peletier ◽  
Riccarda Rossi ◽  
Giuseppe Savaré ◽  
Oliver Tse

AbstractWe have created a functional framework for a class of non-metric gradient systems. The state space is a space of nonnegative measures, and the class of systems includes the Forward Kolmogorov equations for the laws of Markov jump processes on Polish spaces. This framework comprises a definition of a notion of solutions, a method to prove existence, and an archetype uniqueness result. We do this by using only the structure that is provided directly by the dissipation functional, which need not be homogeneous, and we do not appeal to any metric structure.


2021 ◽  
Vol 11 (1) ◽  
Author(s):  
Andrey A. Pil’nik ◽  
Andrey A. Chernov ◽  
Damir R. Islamov

AbstractIn this study, we developed a discrete theory of the charge transport in thin dielectric films by trapped electrons or holes, that is applicable both for the case of countable and a large number of traps. It was shown that Shockley–Read–Hall-like transport equations, which describe the 1D transport through dielectric layers, might incorrectly describe the charge flow through ultra-thin layers with a countable number of traps, taking into account the injection from and extraction to electrodes (contacts). A comparison with other theoretical models shows a good agreement. The developed model can be applied to one-, two- and three-dimensional systems. The model, formulated in a system of linear algebraic equations, can be implemented in the computational code using different optimized libraries. We demonstrated that analytical solutions can be found for stationary cases for any trap distribution and for the dynamics of system evolution for special cases. These solutions can be used to test the code and for studying the charge transport properties of thin dielectric films.


Catalysts ◽  
2021 ◽  
Vol 11 (2) ◽  
pp. 284
Author(s):  
Faranak Foroughi ◽  
Jacob J. Lamb ◽  
Odne S. Burheim ◽  
Bruno G. Pollet

Sonoelectrochemistry is the combination of ultrasound and electrochemistry which provides many advantages in electrochemistry, such as fast reaction rates, surface cleaning and activation, and increased mass transport at an electrode. Due to the advantages, some efforts have been made in order to benefit sonoelectrochemistry in the field of energy and environmental engineering. This review paper highlights the developed progress of the application of sonoelectrochemistry in the production of hydrogen, electrocatalyst materials and electrodes for fuel cells and semiconductor photocatalyst materials. This review also provides the experimental methods that are utilized in several sonoelectrochemical techniques, such as different set-ups generally used for the synthesis of energy-related materials. Different key parameters in the operation of sonoelectrochemical synthesis including ultrasonication time, ultrasound frequency and operation current have been also discussed. There are not many research articles on the sonoelectrochemical production of materials for supercapacitors and water electrolyzers which play crucial roles in the renewable energy industry. Therefore, at the end of this review, some articles which have reported the use of ultrasound for the production of electrocatalysts for supercapacitors and electrolyzers have been reviewed. The current review might be helpful for scientists and engineers who are interested in and working on sonoelectrochemistry and electrocatalyst synthesis for energy storage and energy conversion.


2020 ◽  
Vol 2020 ◽  
pp. 1-10
Author(s):  
Vinh Tien Nguyen ◽  
Khanh Son Trinh

Copper (I) oxide nanoparticles (Cu2O NP) were synthesized by reducing CuSO4 with glucose in the presence of polyvinyl alcohol as a capping agent. We used three different synthetic procedures with a fast reaction (procedure 1p), a fast-then-slow reaction (procedure 2p), and a slow-then-fast reaction (procedure 3p). The reaction rates were controlled by changing the temperature and the speed of adding reagents. The synthesized Cu2O NP were subsequently incubated for 24 h in a pH 6 solution (Cu2O NP6) or a pH 8 solution (Cu2O NP8) at 5°C. XRD and SEM images analysis revealed that the 1p procedure produced smaller NP, while the 2p procedure produced larger but more uniform NP. The 3p procedure produced the largest NP with a higher size variation. The 24-hour acidic postsynthesis incubation resulted in an etching effect, which reduced the size and size variation of Cu2O NP6. To evaluate the antibacterial activity, E. coli suspensions were mixed with the obtained Cu2O NP (32, 96, or 160 ppm) for different time intervals (1 or 24 h) and then grown on Petri dishes at 37°C for 24 h. Higher doses, smaller sizes of Cu2O NP, and longer contact times with the bacterial suspension resulted in higher inactivation efficiencies. Cu2O NP6 showed higher antibacterial effects at low doses, possibly due to the etching effect and the positive surface charge. Increasing the Cu2O doses from 32 to 96 and 160 ppm noticeably increased the antibacterial effect of the Cu2O NP8, but not significantly for Cu2O NP6. We suggested that the Cu2O NP6 suffered from agglomeration at high doses due to their high surface activity and low surface charges.


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