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There is increasing concern about environmental pollution by diffuse emissions of various environmental hazards emitted by transportation activities. For the first time substances released by railways to the environment were investigated. We considered the ...
We investigate the structure and mobility of single self-interstitial atom and vacancy defects in body-centered-cubic transition metals forming groups 5B (vanadium, niobium, and tantalum) and 6B (chromium, molybdenum, and tungsten) of the Periodic Table. D ...
We report about an electron energy-loss study on the dispersion of the charge-carrier plasmon in the charge-density-wave system 2H-TaSe2 above and below the metal-insulator transition. In both cases we find a negative slope, which is in remarkable contrast ...
The high-temperature wettability of AlN particle preforms with pure molten Cu, Al and Ph is quantified by means of drainage curves measured during pressure infiltration. By integrating the drainage curves obtained in this study, the work of immersion for e ...
The press-cake (PC) of oleaginous species (Brassica napus, Moringa oleifera, Glycine max) has been investigated as a biosorbent for metals removal from contaminated water. ...
Copper and its alloys generally display a severe reduction in ductility between roughly 300 and 600 degrees C, a phenomenon variously called 'intermediate temperature embrittlement' or 'ductility trough behaviour'. This review of the phenomenon begins by p ...
Diffusion of carbon is the crucial step in chemical vapor deposition (CVD) growth of carbon nanotubes (CNTs) On metal nanoparticles. Using first principles techniques we model the binding and diffusion of carbon atoms and dimers on late transition (Ni, Pd, ...
This work is currently under development within the framework of an American-European project (Digimat Project). The paper details the development of some numerical tools dedicated to the digital representation of metallic materials structures, to the fini ...
The discovery of the anticancer properties of cisplatin in 1965 heralded the development of metallopharmaceuticals and founded a revolution in cancer therapy. Platinum drugs are believed to induce cytotoxicity by cross-linking DNA, causing changes to the D ...
The linking of atomistic simulations of stress-driven processes to experimentally observed mechanical behavior via the computation of activation energy barriers is a topic of intense current research. Using dislocation nucleation from a crack tip as the re ...