scholarly journals Theoretical evaluation of the role of crystal defects on local equilibrium and effective diffusivity of hydrogen in iron

2017 ◽  
Vol 33 (13) ◽  
pp. 1505-1514 ◽  
Author(s):  
D. Bombac ◽  
I. H. Katzarov ◽  
D. L. Pashov ◽  
A. T. Paxton
Desalination ◽  
2006 ◽  
Vol 200 (1-3) ◽  
pp. 256-258
Author(s):  
A. Gugliuzza ◽  
G. De Luca ◽  
E. Tocci ◽  
L. De Lorenzo ◽  
E. Drioli

1986 ◽  
Vol 50 (357) ◽  
pp. 469-473 ◽  
Author(s):  
J. R. Ashworth

AbstractThe data of Joesten (1986) are re-interpreted. The petrography of the coronas is not consistent with magrnatic origin. Both microstructural types described by Joesten (1986), here re-named ‘columnar’ and ‘tabular’, formed by solid-state replacement of plagioclase and of adjacent olivine or ilmenite. Tabular microstructures are not annealed, but result from overgrowth or epitaxy of amphibole and pyroxene on pre-existing grains. Since the diffusion-controlled models of Joesten (1986) can account for major aspects of the coronas, it seems possible that a slightly modified, less simplified theory might explain them fully. Open-system behaviour must be admitted, with some constraints provided by symplectites. It may also be necessary to develop the theory in more than one dimension, and to allow for departures from local equilibrium at layer boundaries.


1997 ◽  
Vol 469 ◽  
Author(s):  
G. Mariani ◽  
B. Pichaud ◽  
E. Yakimov

ABSTRACTThe substitutional gold concentration introduced by a diffusion step between 850 and 1000°C was measured by Deep Level Transient Spectroscopy (DLTS) both in FZ and Cz silicon containing different dislocation densities introduced by cantilever bending. The comparison, in the same sample, of dislocated and undislocated regions allows first the self interstitial (Sii) effective diffusivity and then the efficiency of dislocations as sinks for self-interstitials γto be measured. In FZ silicon, γ is quite independent of temperature whereas in Cz Si a remarkable temperature dependence was observed, with an effective activation energy of leV, which can be attributed to the release of dislocations by a thermally stimulated climbing mechanism from obstacles (oxygen segregation or precipitation). Increasing the gold diffusion annealing times for a given temperature (850°C) underlines once more the role of the oxygen precipitation in the samples.


Author(s):  
L. C. D. Fielding ◽  
E. J. Song ◽  
D. K. Han ◽  
H. K. D. H. Bhadeshia ◽  
D.-W. Suh

The diffusion of hydrogen in austenite is slower than in ferrite. Experiments have been conducted to study the behaviour of hydrogen in a nanostructured steel sample consisting of a mixture of thin plates of bainitic ferrite and intervening films of retained austenite, with the latter phase present in a quantity larger than the percolation threshold, i.e. it has three-dimensional connectivity. The structure was then heat treated to control the fraction of austenite, and hence to study the role of hydrogen when the austenite decomposes below the value required to sustain percolation. The experiments have involved both thermal desorption analysis and permeation, and when combined with theoretical analysis, indicate a significant influence of percolating austenite in hindering the passage of hydrogen into the steel during hydrogen charging, and its permeation through the composite nanostructure. The effect is not as large as might be expected from a simple comparison of independent data on the diffusivities of hydrogen in the two lattices, because the effective diffusivity in ferrite is found to be much smaller than in the defect-free ferrite, owing to trapping effects. The morphology of the austenite is demonstrated to play a role by comparing with a sample containing a larger volume fraction of austenite but present as isolated grains which are ineffective to the permeation of hydrogen.


2020 ◽  
Author(s):  
Ivan Ricardo Vega Valdez ◽  
Jose-Martin Santiago-Quintana ◽  
MELVIN ROSALEZ ◽  
Eunice Farfan ◽  
Marvin A. Soriano-Ursua

The aim of the present docking study was to explore the putative role of boronic moieties in molecules interacting on the binding site of the SARS-CoV-2 main protease. The methodology was based on the conventional docking procedure by means of AutoDock software by assaying boron-free and boron-containing compounds on the recent reported crystal structure of SARS-CoV-2 main protease (PDB code: 6LU7). The most of tested compounds share contact with key residues and poses on the cleavage pocket. Those compounds with a boron atom in its structure often were estimated with higher affinity than boron-free analogues. Interactions and affinity of boron-containing peptidomimetics on the binding site let us to propose the potent inhibition of these compounds on targeted protease. These advances may be relevant for drug designing, but also to suggest the testing of available boron-containing drugs in patients with severe symptoms of COVID19 infection.


2018 ◽  
Author(s):  
Genevieve Jay Brett ◽  
Larry Pratt ◽  
Irina Rypina ◽  
Peng Wang

Abstract. The importance of chaotic advection relative to turbulent diffusion is investigated in an idealized model of a 3D swirling and overturning ocean eddy. Various measures of stirring and mixing are examined in order to determine when and where chaotic advection is relevant. Turbulence is alternatively represented by: 1) an explicit, observation–based, scale–dependent eddy diffusivity, 2) stochastic noise, added to a deterministic velocity field, or 3) explicit and implicit diffusion in a spectral numerical model of Navier–Stokes equations. Lagrangian chaos in our model occurs only within distinct regions of the eddy, including a large chaotic ‘sea’ that fills much of the volume near the perimeter and central axis of the eddy, and much smaller ‘resonant’ bands. The size and distribution of these regions depends on factors such as the degree of axial asymmetry of the eddy and the Ekman number. The relative importance of chaotic advection and turbulent diffusion within the chaotic regions is quantified using three measures: the ratio of the tracer filament arrest scale to the width of the chaotic region, the rate of dispersal of closely spaced fluid parcels, and the Nakamura effective diffusivity. The role of chaotic advection in the stirring of a passive tracer is generally found to be most important within the larger chaotic ‘seas’, at intermediate times, with small diffusivities, and for eddies with strong asymmetry. In contrast, in thin chaotic regions, turbulent diffusion at oceanographically relevant rates is at least as important as chaotic advection. Future work should address anisotropic and spatially–varying representations of turbulence for more realistic models.


IIUC Studies ◽  
1970 ◽  
Vol 3 ◽  
pp. 83-92 ◽  
Author(s):  
Kamiz Uddin Ahmed Alam ◽  
Mohammad Aman Uddin Muzahid

This article attempts to focus on Islamic education in the informal setting, its correspondence with human resource development and the role of this development to create a sound and balanced environment in society with moral and spiritual values. Firstly, the paper addresses education and its function in general and then education from Islamic perspective. Secondly, it discusses the character of informal Islamic education, the role players of the field of informal Islamic education, their status as teachers, the role of a teacher, the competencies of a teacher, and teacher - learner relationship in the light of Islamic culture and heritage. Finally, a proposal on the specific subject of Informal Islamic education and the strategies of imparting it are presented in the article.   doi: 10.3329/iiucs.v3i0.2667   IIUC STUDIES Vol. - 3, December 2006 (p 83-92)


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