CALCULATION OF THE ACTIVATION ENERGY OF CHEMICAL REACTIONS ON THE BASIS OF THE ADDITIVITY PRINCIPLE

1967 ◽  
Vol 36 (7) ◽  
pp. 511-521 ◽  
Author(s):  
F B Moin
2013 ◽  
Vol 2013 ◽  
pp. 1-11 ◽  
Author(s):  
Kh. Abdul Maleque

A local similarity solution of unsteady MHD natural convection heat and mass transfer boundary layer flow past a flat porous plate within the presence of thermal radiation is investigated. The effects of exothermic and endothermic chemical reactions with Arrhenius activation energy on the velocity, temperature, and concentration are also studied in this paper. The governing partial differential equations are reduced to ordinary differential equations by introducing locally similarity transformation (Maleque (2010)). Numerical solutions to the reduced nonlinear similarity equations are then obtained by adopting Runge-Kutta and shooting methods using the Nachtsheim-Swigert iteration technique. The results of the numerical solution are obtained for both steady and unsteady cases then presented graphically in the form of velocity, temperature, and concentration profiles. Comparison has been made for steady flow () and shows excellent agreement with Bestman (1990), hence encouragement for the use of the present computations.


Author(s):  
Ahmadreza Amini ◽  
Ko-ichiro Ohno ◽  
Takayuki Maeda ◽  
Kazuya Kunitomo ◽  
Keiichiro Kashimura

Microwave irradiation is an energy-efficient and a rapid-heating method to decrease the activation energy of chemical reactions via both thermal and non-thermal effects of microwave photons 1). Recently, hydrogen-reduction during microwave heating has been proposed for magnetite reduction to combine the advantages of microwave irradiation and using H2 as a reducing agent during iron production 2). In the present study, as a novel idea, the traditional microwave heating system was equipped with thermobalance to investigate the kinetics of H2-reduction of FeS-CaO mixture (FeS(s) + CaO(s) + H2(g) = Fe(s) + CaS(s) + H2O(g)) under microwave heating at 2.45 GHz to further mitigate CO2 emission and prevent SO2 release during iron production from a sulfide mineral. Microscope observations revealed that the un-reacted core model can be employed for such a kinetic study. Linearity (R2) of different rate-controlling mechanisms after a 10-minute reduction reaction demonstrated that the gas diffusion in micropores of reduced metallic Fe is a dominant rate-controlling mechanism while the interfacial chemical reaction is progressed rapidly. This is attributed to extraordinary effects of microwave irradiation on speeding up the chemical reactions 3), while the formation of Fe shell on the surface of FeS/FeO particles decreases the accessibility of gas to un-reacted parts, resulting in a lower rate of gas diffusion in micropores. Moreover, the diffusion coefficients (De) at 460, 570, and 750 °C were calculated from the plot of the gas diffusion, as illustrated in Fig. 1, wherein the X is reduction degree: where Wi (g) is the initial weight of the sample, Wt (g) is the weight of the sample after treatment for t seconds, Wht (g) is the weight change of the sample owing to the dehydration reaction, and WO (-) is the stoichiometric weight ratio of oxygen in the sample, which is 0.111. Consequently, the activation energy of 22.3 kJ.mol-1 was attained from the Arrhenius equation for the hydrogen-reduction reaction of FeS-CaO mixture under microwave heating.


2021 ◽  
pp. 228-254
Author(s):  
Christopher O. Oriakhi

Chemical Kinetics discusses the rate at which chemical reactions occur and how these rates can be expressed mathematically, with a review of the factors which affect reaction rates. Topics presented with a numerical focus include reaction rate measurements, rate laws and their components including rate constants, determination of reaction orders from integrated rate laws, and effects of temperature on rates. Reaction half life and its determination are discussed. Collision theory, which forms the basis of the rate law, is presented with emphasis on the effect of temperature on the rate constant and the rate. The Arrhenius equation and the concept of activation energy are discussed with illustrative calculations for determining the energy of activation.


1934 ◽  
Vol 30 (4) ◽  
pp. 508-513
Author(s):  
R. A. Smith

A considerable amount of work has recently been done on the application of wave-mechanics to the theoretical study of chemical reactions. This has consisted chiefly in calculating activation energies and strengths of various bonds by consideration of electronic states in molecules. Some work has also been done on actual reaction mechanisms. It is evident from the latter that, owing to the large masses of the particles concerned, the quantum theory and the classical treatment will give different results only for reactions involving hydrogen or diplogen. Previous attempts to deal with such reactions have consisted simply of calculating the permeabilityG(W) of a barrier of height equal to the activation energy for protons of energyW.The reaction rate is then assumed to be given by


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