Comparison of the rates of uni- and bimolecular diffusion-controlled reactions on circular filled aggregates and diffusion-limited fractal aggregates in two dimensions

1987 ◽  
Vol 91 (11) ◽  
pp. 3002-3006 ◽  
Author(s):  
Chan Lon. Yang ◽  
Zhong Ying. Chen ◽  
Mostafa A. El-Sayed
1996 ◽  
Vol 464 ◽  
Author(s):  
Eric Monson ◽  
Anna L. Lin ◽  
Raoul Kopelman

AbstractA focused laser beam acts as both a “phototrap”, bleaching fluorophore molecules which diffuse into the beam path, and as a confocal probe, detecting the excited, unbleached fluorophore molecules still present in the trap. With this focused laser beam, we observe anomalous asymptotic rate laws similar to those predicted for a diffusion-controlled elementary trapping reaction, A + T → T, in one and two dimensions. One dimensional diffusion-limited trapping kinetics are approached in capillaries with 10 μm diameters while two dimensional diffusion limited trapping kinetics are observed with unstirred samples having a quasi 2-D geometry. In the presence of stirring, the 2-D samplesexhibit the classical, constant trapping rate over time.


2009 ◽  
Vol 423 ◽  
pp. 75-82 ◽  
Author(s):  
Liz Añez ◽  
Juan Primera ◽  
Anwar Hasmy ◽  
Pedro Franceschini ◽  
Néstor Sánchez ◽  
...  

This study introduces a method for a computational calculus of the Elasticity Modulus (E) of simulated porous media using the Monte Carlo technique. The porous media of known geometry is simulated as an elastic network of central forces, to which a known deformation is applied. The minimum strain energy is calculated applying the Monte Carlo technique. The Elasticity Modulus is obtained from the theoretical relations between the elastic energy of a system and its deformation. The computational method is validated by applying it in systems of known analytic solution and over porous media generated through aggregation algorithm in two dimensions i.e. Random Sequential Aggregation and Diffusion Limited Cluster-Cluster Aggregation (RSA and DLCA respectively). The latter used to simulate the structure of silica aerogels. As for the range of concentrations studied for the DLCA and RSA systems, it was found that the elasticity modulus E decreases as the porosity of the system increases, being the E value higher for the DLCA system with respect to RSA. The method used is able to differentiate the elastic properties for two different aggregation models. Being E values different for equal porosities, the coordination number (Z) was the geometric parameter that best explains the behavior of the Elasticity Modulus.


2021 ◽  
pp. 0271678X2110041
Author(s):  
Jesse A Stokum ◽  
Bosung Shim ◽  
Weiliang Huang ◽  
Maureen Kane ◽  
Jesse A Smith ◽  
...  

The perivascular astrocyte endfoot is a specialized and diffusion-limited subcellular compartment that fully ensheathes the cerebral vasculature. Despite their ubiquitous presence, a detailed understanding of endfoot physiology remains elusive, in part due to a limited understanding of the proteins that distinguish the endfoot from the greater astrocyte body. Here, we developed a technique to isolate astrocyte endfeet from brain tissue, which was used to study the endfoot proteome in comparison to the astrocyte somata. In our approach, brain microvessels, which retain their endfoot processes, were isolated from mouse brain and dissociated, whereupon endfeet were recovered using an antibody-based column astrocyte isolation kit. Our findings expand the known set of proteins enriched at the endfoot from 10 to 516, which comprised more than 1/5th of the entire detected astrocyte proteome. Numerous critical electron transport chain proteins were expressed only at the endfeet, while enzymes involved in glycogen storage were distributed to the somata, indicating subcellular metabolic compartmentalization. The endfoot proteome also included numerous proteins that, while known to have important contributions to blood-brain barrier function, were not previously known to localize to the endfoot. Our findings highlight the importance of the endfoot and suggest new routes of investigation into endfoot function.


2021 ◽  
Vol 29 ◽  
pp. 95-115
Author(s):  
Rafal Kozubski ◽  
Graeme E. Murch ◽  
Irina V. Belova

We review the results of our Monte Carlo simulation studies carried out within the past two decades in the area of atomic-migration-controlled phenomena in intermetallic compounds. The review aims at showing the high potential of Monte Carlo methods in modelling both the equilibrium states of the systems and the kinetics of the running processes. We focus on three particular problems: (i) the atomistic origin of the complexity of the ‘order-order’ relaxations in γ’-Ni3Al; (ii) surface-induced ordering phenomena in γ-FePt and (iii) ‘order—order’ kinetics and self-diffusion in the ‘triple-defect’ β-NiAl. The latter investigation demonstrated how diverse Monte Carlo techniques may be used to model the phenomena where equilibrium thermodynamics interplays and competes with kinetic effects.


2012 ◽  
Vol 9 (4) ◽  
pp. 1864-1874
Author(s):  
V. Nagaraju ◽  
R. Sreenivasulu ◽  
P. Venkata Ramana

The electrochemical behaviour of N′-(p-toluenesulphonyl)-3-methyl-4-(4′-substituted arylhydrazono) pyrazolin-5-ones has been investigated at dme and gc electrodes in buffer solutions of pH 2.0, 4.0, 6.0, 8.0 and 10.0 using dc polarography and cyclic voltammetry and coulometry. The compounds exhibit one well defined wave in the entire pH range of study. The process is irreversible and diffusion controlled. Controlled potential electrolysis indicates the involvement of four electrons in the reduction process. The effect of solvent, cations and anions, temperature and substitutents on the mechanism of reduction has been studied. Based on the results obtained the mechanism of reduction has been suggested.


1995 ◽  
Vol 407 ◽  
Author(s):  
H. Brune ◽  
K. Bromann ◽  
K. Kern ◽  
J. Jacobsen ◽  
P. Stoltze ◽  
...  

ABSTRACTThe similarity of patterns formed in non-equilibrium growth processes in physics, chemistry and biology is conspicuous and many attempts have been made to discover common mechanisms underlying their growth. The central question in this context is what causes some patterns to be dendritic, as e.g. snowflakes, while others grow fractal (randomly ramified). Here we report a crossover from fractal to dendritic patterns for growth in two dimensions: the diffusion limited aggregation of Ag atoms on a Pt(111) surface as observed by means of variable temperature STM. The microscopic mechanism of dendritic growth can be analyzed for the present system. It originates from the anisotropy of the diffusion of adatoms at corner sites which is linked to the trigonal symmetry of the substrate. This corner diffusion is observed to be active as soon as islands form, therefore, the classical DLA clusters with the hit and stick mechanism do not form. The ideas on the mechanism for dendritic growth have been verified by kinetic Monte-Carlo simulations which are in excellent agreement with experiment.


1997 ◽  
Vol 481 ◽  
Author(s):  
E. Pineda ◽  
T. Pradell ◽  
D. Crespo ◽  
N. Clavaguera ◽  
J. ZHU ◽  
...  

ABSTRACTThe microstructure developed in primary crystallizations is studied under realistic conditions. The primary crystallization of an amorphous alloy is modeled by considering the thermodynamics of a metastable phase transition and the kinetics of nucleation and crystal growth under isothermal annealing. A realistic growth rate, including an interface controlled growth at the beginning of the growth of each single grain and diffusion controlled growth process with soft impingement afterwards is considered. The reduction in the nucleation rate due to the compositional change in the remaining amorphous matrix is also taken into account. The microstructures developed during the transformation are obtained by using the Populational KJMA method, from the above thermodynamic and kinetic factors. Experimental data of transformed fraction, grain density, average grain size, grain size distribution and other related parameters obtained from annealed metallic glasses are modeled.


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