Search results for " kinetics"
showing 10 items of 285 documents
Effect of temperature on the passive state of Alloy 31 in a LiBr solution: Passivation and Mott-Schottky analysis
2015
The passive behaviour of Alloy 31, a highly-alloyed austenitic stainless steel (UNS N08031), has been investigated in a LiBr heavy brine (700 g/l) at different temperatures using potentiostatic polarisation and Mott-Schottky analysis. Cation vacancies have been found to be the dominant defect in the passive films formed on Alloy 31. An increase in temperature enhanced the generation of cation vacancies at the film/solution interface and raised the steady-state passive current density. The density of defects within the passive film also increased significantly with temperature, making the film more conductive and less protective against localised attacks.
Rate Theory for Electrocatalytic Systems: Fixed Potential Formulation for General, Electron Transfer, and Proton-Coupled Electron Transfer Reactions
2019
Atomistic modeling of electrocatalytic reactions is most naturally conducted within the grand canonical ensemble (GCE) which enables fixed chemical potential calculations. While GCE has been widely adopted for modeling electrochemical and electrocatalytic thermodynamics, the electrochemical reaction rate theory within GCE is lacking. Molecular and condensed phase rate theories are formulated within microcanonical and canonical ensembles, respectively, but electrocatalytic systems described within the GCE require extension of the conventionally used rate theories for computation reaction rates at fixed electrode potentials. In this work, rate theories from (micro) canonical ensemble are gene…
Tumor biology and experimental therapeutics.
2000
Recent research using multicellular tumor spheroids has resulted in new insights in the regulation of invasion and metastasis, angiogenesis and cell cycle kinetics. The onset and expansion of central necrosis in tumor spheroids has been characterized to be a complex interaction of several mechanisms; in a number of cases, necrosis is not a consequence of hypoxia or anoxia, but emerges as secondary necrosis following an accumulation of apoptosis in spheroids. Recent therapeutically oriented studies have been directed towards novel hypoxic markers, targeted therapy, multicellular-mediated drug resistance, and heavy ion irradiation of spheroids. Research efforts should be enhanced mainly in th…
Importance of the liquid to solid weight ratio in the powdered solid-liquid reactions Example drawn from cement constituent hydration
1997
Abstract It seems justified to wonder if the chemical processes which have been evidenced from diluted stirred suspensions are or are not in accordance with those involved in a stagnant paste. The present paper is aimed at clarifying this question which is in connection with the problem of the so called ‘dormant period’ or ‘induction period’ at the beginning of the hydration of Portland cement.
Hydration of cementitious materials, present and future
2011
This paper is a keynote presentation from the 13th International Congress on the Chemistry of Cement. It discusses the underlying principles of hydration and recent evidence for the mechanisms governing this process in both Portland cements and other cementitious materials. Given the overriding imperative to improve the sustainability of cementitious materials, routes to reducing CO2 emissions are discussed and the impact of supplementary materials on hydration considered. (C) 2011 Elsevier Ltd. All rights reserved.
Assessment of Postharvest Dehydration Kinetics and Skin Mechanical Properties of “Muscat of Alexandria” Grapes by Response Surface Methodology
2016
The dipping of berries in a dilute solution of sodium hydroxide during a short time was evaluated as pretreatment undertaken prior to convective dehydration of wine grapes. The impact of the sodium hydroxide content and dipping time on weight loss (WL) at different dehydration times was thoroughly assessed using central composite design (CCD) and response surface methodology (RSM). Furthermore, the effects of these two variables were also investigated on the skin mechanical properties of dehydrated grapes. The effect of these two pretreatment factors on the dehydration kinetics and skin hardness was satisfactorily fitted to regression models. The berry pretreatment with low sodium hydroxide…
Dynamic Self-Consistent Field Approach for Studying Kinetic Processes in Multiblock Copolymer Melts
2020
The self-consistent field theory is a popular and highly successful theoretical framework for studying equilibrium (co)polymer systems at the mesoscopic level. Dynamic density functionals allow one to use this framework for studying dynamical processes in the diffusive, non-inertial regime. The central quantity in these approaches is the mobility function, which describes the effect of chain connectivity on the nonlocal response of monomers to thermodynamic driving fields. In a recent study [Mantha et al, Macromolecules 53, 3409 (2020)], we have developed a method to systematically construct mobility functions from reference fine-grained simulations. Here we focus on melts of linear chains …
Electrochemical characterization of solid state reaction kinetics using voltammetry of microparticles. Application to thermal decomposition of iron c…
2011
The voltammetry of microparticles is applied to characterize the electrocatalytic ability of solids towards selected electrochemical processes. The variation of catalytic currents under fixed electrochemical conditions permits to obtain composition/time data to be fitted with solid state kinetic models. This methodology is applied to analyze the thermal decomposition of magnesiochromite ferroan and chlorite chromian standards and a South Africa iron chromite ore on the basis of the significant catalytic effect on the electrochemical oxygen evolution reaction (OER) in aqueous alkaline media at mineral-modified graphite electrodes. Measurement of the time variation of catalytic current for OE…
Kinetische untersuchungen zur strahleninduzierten festkörperpolymerisation von trioxan und tetroxan IV. Mitt. der Reihe “kinetische und morphologisch…
1971
Die strahlungsinduzierte Polymerisation von kristallinem Tetroxan und Trioxan wurde untersucht und der Einflus von Strahlendosis, Reaktionszeit und -temperatur auf den Umsatz und das Molekulargewicht der entstehenden POM, insbesondere bei der Nachpolymerisation, studiert. Die Zeit-Umsatz-Kurven fur die Nachpolymerisation laufen bei beiden Monomeren asymptotisch gegen einem Grenzwert des Umsatzes, der mit steigender Reaktionstemperatur ansteigt. Die Aktivierungsenergie der Nachpolymerisation wurde zu 24 ± 2 kcal/Mol fur Tetroxan und zu 36–38 kcal/Mol fur Trioxan bestimmt. Die Zeit(t)-Umsatz(x)-Kurven fur Tetroxan lassen sich durch die empirische Gleichung: beschreiben, wobei k1 und k2 Konsta…