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Activation Energy Values (activation + energy_value)
Selected AbstractsEffect of temperature, organic amendment rate and moisture content on the degradation of 1,3-dichloropropene in soil,PEST MANAGEMENT SCIENCE (FORMERLY: PESTICIDE SCIENCE), Issue 12 2001Robert S Dungan Abstract 1,3-Dichloropropene (1,3-D), which consists of two isomers, (Z)- and (E)-1,3-D, is considered to be a viable alternative to methyl bromide, but atmospheric emission of 1,3-D is often associated with deterioration of air quality. To minimize environmental impacts of 1,3-D, emission control strategies are in need of investigation. One approach to reduce 1,3-D emissions is to accelerate its degradation by incorporating organic amendments into the soil surface. In this study, we investigated the ability of four organic amendments to enhance the rate of degradation of (Z)- and (E)-1,3-D in a sandy loam soil. Degradation of (Z)- and (E)-1,3-D was well described by first-order kinetics, and rates of degradation for the two isomers were similar. Composted steer manure (SM) was the most reactive of the organic amendments tested. The half-life of both the (Z)- and (E)-isomers in unamended soil at 20,°C was 6.3 days; those in 5% SM-amended soil were 1.8 and 1.9 days, respectively. At 40,°C, the half-life of both isomers in 5% SM-amended soil was 0.5 day. Activation energy values for amended soil at 2, 5 and 10% SM were 56.5, 53.4 and 64.5,kJ,mol,1, respectively. At 20,°C, the contribution of degradation from biological mechanisms was largest in soil amended with SM, but chemical mechanisms still accounted for more than 58% of the (Z)- and (E)-1,3-D degradation. The effect of temperature and amendment rate upon degradation should be considered when describing the fate and transport of 1,3-D isomers in soil. Use of organic soil amendments appears to be a promising method to enhance fumigant degradation and reduce volatile emissions. Published in 2001 for SCI by John Wiley & Sons, Ltd [source] Convective hot air drying of blanched yam slicesINTERNATIONAL JOURNAL OF FOOD SCIENCE & TECHNOLOGY, Issue 7 2008Olajide Philip Sobukola Summary In this study, a laboratory convective hot air dryer was used for the thin layer drying of blanched yam slices and experimental moisture ratio was compared with Newton, Logarithmic, Henderson and Pabis, modified Henderson and Pabis, approximation of diffusion, modified page 1, two-term exponential, Verma et al. and Wang and Singh models. Among all the models, the approximation of diffusion model was found to satisfactorily describe the kinetics of air-drying of blanched yam slices. The increase in air temperature significantly reduced the drying time with no constant rate period but drying occurs in falling rate period. The effective diffusivity values varied between 7.62 × 10,8 to 9.06 × 10,8 m2 s,1 and increased with increase in temperature. An Arrhenius relation with an activation energy value of 8.831 kJ mol,1 showed the effect of temperature on moisture diffusivity. [source] Thermal, phase transition and spectral studies in erythromycin pseudopolymorphs: dihydrate and acetone solvateCRYSTAL RESEARCH AND TECHNOLOGY, Issue 12 2006Zhanzhong Wang Abstract The thermal, phase transition and spectral studies of erythromycin A dihydrate and acetone solvate were performed by Differential Scanning calorimetry (DSC), Thermo Gravimetry (TG-DTA), X-Ray Powder Diffraction (XRPD) and Fourier Transform Infra-Red (FTIR) spectrum. The non-thermal kinetic analysis of erythromycin A dihydrate was carried out by DSC at different heating rates in dynamic nitrogen atmosphere. The result showed that heating rate has substantial influence on the thermal behavior of erythromycin dihydrate. The Arrhenius parameters were estimated according to the Kissinger method. Corresponding to dehydration of dihydrate, melting of dehydrated dihydrate, phase transition from dehydrated dihydrate to anhydrate, and melting of anhydrate, the calculated activation energy were 39.60, 269.85, 261.23, and 582.16 kJmol,1, the pre-exponential factors were 3.46 × 103, 8.06 × 1032, 9.23 × 1030, and 7.29 × 1063 s,1, respectively. Ozawa method was used to compare activation energy values calculated by Kissinger method. (© 2006 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim) [source] Two variable semi-empirical and artificial neural-network-based modeling of peptide mobilities in CZE: The effect of temperature and organic modifier concentrationELECTROPHORESIS, Issue 5 2009Stefan Mittermayr Abstract This work was focused on investigating the effects of two separation influencing parameters in CZE, namely temperature and organic additive concentration upon the electrophoretic migration properties of model tripeptides. Two variable semi-empirical (TVSE) models and back-propagation artificial neural networks (ANN) were applied to predict the electrophoretic mobilities of the tripeptides with non-polar, polar, positively charged, negatively charged and aromatic R group characteristics. Previously published work on the subject did not account for the effect of temperature and buffer organic modifier concentration on peptide mobility, in spite of the fact that both were considered to be influential factors in peptide analysis. In this work, a substantial data set was generated consisting of actual electrophoretic mobilities of the model tripeptides in 30,mM phosphate buffer at pH 7.5, at 20, 25, 30, 35 and 40°C and at four different organic additive containing running buffers (0, 5, 10 and 15% MeOH) applying two electric field strengths (12 and 16,kV) to assess our mobility predicting models. Based on the Arrhenius plots of natural logarithm of mobility versus reciprocal absolute temperature of the various experimental setups, the corresponding activation energy values were derived and evaluated. Calculated mobilities by TVSE and back-propagation ANN models were compared with each other and to the experimental data, respectively. Neural network approaches were able to model the complex impact of both temperature and organic additive concentrations and resulted in considerably higher predictive power over the TVSE models, justifying that the effect of these two factors should not be neglected. [source] Theoretical study of the reaction of alkynes with furan catalyzed by AuCl3 and AuClINTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, Issue 2 2007Hassan Rabaâ Abstract A general scheme for the endo- and exo-cyclization of furan reactivity with [L -AuIII, IClx] with (x = 3, 1 and L -acetylene and vinylidene) complexes is investigated using density functional theory (DFT) code. Two conceivable mechanisms via a [4 + 2] Diels,Alder process or carbene complex are analyzed. According to the activation energy values of the gold (III and I) catalyst, the first mechanism, which implies the Diels,Alder reaction of AuIII, is thermodynamically favored and gives more evidence of the intramolecular addition of the furan with the alkynes. The second mechanism, presumably assisted by the spontaneous formation of the exo-vinylidene complexes and intermediates of gold (III, I) by forming the carbene complex, is kinetically favored. Additionally, we compare our results with other structures with intramolecular additions that exhibit the quasi-similarity of gold analogue structures. Differences in activation energies are observed, according to the functional used. Finally, we probe the solvent effects, which decrease the energy barrier in the path. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007 [source] RHEOLOGICAL BEHAVIOR OF POMEGRANATE (PUNICA GRANATUM L.) JUICE AND CONCENTRATEJOURNAL OF TEXTURE STUDIES, Issue 1 2005N ALTAN ABSTRACT The rheological behavior of pomegranate juice (Punica granatum L.), prepared from fresh pomegranates, was studied as a function of solids concentration in the range 17.5,75°Brix at 10,55C, using a controlled stress rheometer. Concentration methods did not influence flow behavior. There were no significant differences (P > 0.05) between viscosity and activation energy values for the pomegranate juices concentrated by different methods. The juices exhibited Newtonian behavior regardless of the concentration method. The effect of temperature was described by an Arrhenius-type equation with an activation energy in the range 5.34,32.2 kJ/mol depending on concentration. An exponential model described better the effect of the soluble solids on the viscosity and Eavalues. A simple equation was proposed for describing the combined effect of temperature and soluble solids content on the juice viscosity. [source] Superplastic Behavior of Fine-Grained ,-Silicon Nitride Material under CompressionJOURNAL OF THE AMERICAN CERAMIC SOCIETY, Issue 4 2000Guo-Dong Zhan The deformation behavior of a hot-pressed, fine-grained ,-Si3N4 ceramic was investigated in the temperature range 1450°,1650°C, under compression, and the results for strain rate and temperature dependence of the flow stress are presented here. The present results show that the material is capable of high rates of deformation (,10,4,10,3 s,1) within a wide range of deformation temperatures and under a pressure of 5,100 MPa; no strain hardening occurs in the material, even at slow deformation rates, because of its stable microstructure; Newtonian flow occurs, with a stress exponent of approximately unity; and the material has activation energy values for flow in the range 344,410 kJ·mol,1. Grain-boundary sliding and grain rotation, accommodated by viscous flow, might be the mechanisms of superplasticity for the present material. [source] Effect of temperature on hygroscopic thickness swelling rate of composites from lignocellolusic fillers and HDPEPOLYMER COMPOSITES, Issue 11 2009Abdollah Najafi Effect of temperature on hygroscopic thickness swelling rate of lignocellolusic fillers/HDPE (high density polyethylene) composites was investigated. The composites were manufactured using a dry blend/hot press method. In this method, powder of plastic and dried powder of lignocellolusic material were mixed in high-speed mixer and then the mixed powder were pressed at 190°C. Lignocellolusic fillers/HDPE composites panels were made from virgin and recycled HDPE (as plastic) and wood sawdust and flour of rice hull (as filler) at 60% by weight filler loadings. Nominal density and dimensions of the panels were 1 g/cm3 and 35 × 35 × 1 cm3, respectively. Thickness swelling rate of manufactured wood plastic composites (WPCs) were evaluated by immersing them in water at 20, 40, and 60°C for reaching a certain value where no more thickness was swelled. A swelling model developed by Shi and Gardner [Compos. A, 37, 1276 (2006)] was used to study the thickness swelling process of WPCs, from which the parameter, swelling rate parameter, can be used to quantify the swelling rate. The results indicated that temperature has a significant effect on the swelling rate. The swelling rate increased as the temperature increased. The swelling model provided a good predictor of the hygroscopic swelling process of WPCs immersed in water at various temperatures. From the activation energy values calculated from the Arrhenius plots, the temperature had less effect on the thickness swelling rate for the composites including wood sawdust compared with the rice hull as filler and the composites including recycled compared with the virgin HDPE as plastic. POLYM. COMPOS., 2009. © 2008 Society of Plastics Engineers [source] The influence of chain-ends on the thermal and rheological properties of some 40/60 PES/PEES copolymersPOLYMER ENGINEERING & SCIENCE, Issue 8 2009Lorenzo Abate Four random, differently ended (Cl, NH2, OH, and COO,), polyethersulfone/polyetherethersulfone (PES/PEES) copolymers were studied to investigate the influence of chain ends on thermal and rheological behaviors. The number average molar mass (Mn , 9500 g·mol,1) and the PES/PEES ratio (40/60) of all copolymers investigated were checked by 1H NMR spectra. Thermal degradations were carried out in the scanning mode and initial decomposition temperatures (Ti) and activation energy values of degradation (Ea) were obtained. Glass transition temperature (Tg) was determined by differential scanning calorimetry and complex viscosity (,*) by rheological measurements in isothermal heating conditions (T = 270°C). All parameters determined were largely affected by copolymer chain ends and decreased according to the same order, OH > NH2 > Cl > COO,. The results were discussed and interpreted. POLYM. ENG. SCI., 2009. © 2009 Society of Plastics Engineers [source] | |||||||||||||