• Journal of the Korean Society of Industry Convergence
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• v.25 no.6_3
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• pp.1275-1284
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• 2022

This study provides an investigating the electrolyte reaction characteristics during thermal runaway of a lithium-ion battery(LIB). Dimethyl carbonate(DMC) is known as the main substance that makes up the electrolyte. The mono-molecular decomposition characteristics of DMC were derived through numerical analysis. Cobalt oxide can release oxygen under high temperature conditions. Also, DMC is converted to CH₄, H₂, CO, and CO₂. Especially, it was found that the decomposition of the DMC begins at a temperature range of 340-350℃, which dramatically increases the internal pressure of the LIB. In the by-products gases, the molar ratio of CO and CO₂ changed according to the molecular structure of DMC and temperature conditions. The correlation of the [CO]/[CO₂] ratio according to the temperature during thermal runaway was derived, and the characteristics of the reaction temperature could be estimated using the molar ratio as an indicator. In addition, the oxidation and decomposition characteristics of DMC according to the residence time for each temperature were estimated. When DMC is exposed to low temperature for a long time, both oxidation and decomposition may occur. There is possibility of not only increasing the internal pressure of the LIB, but also promoting thermal runaway. In this study, internal environment of LIB was identified and the reaction characteristics between the active materials of the cathode and electrolyte were investigated.

• Korean Chemical Engineering Research
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• v.50 no.5
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• pp.766-771
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• 2012

PC (polycarbonate) is one of the widely used engineering plastics. Polycarbonate (PC) is traditionally produced by the reaction of phosgene and bisphenol-A. This phosgene process has the disadvantage as the high toxicity and corrosiveness of phosgene. The main point of focus to overcome the disadvantage of phosgene based process has been a route through dimethyl carbonate (DMC) to diphenyl carbonate (DPC). In this paper, for the DPC synthesis reaction using PBO as a catalyst, the effect of reaction temperature, reactant ratio, catalyst concentration on the reaction yield was investigated. A kinetic model for the DPC synthesis reaction was proposed and kinetic parameters for the proposed model was determined from batch reactor experiments. The predicted results by the proposed model were in good agreement with the experimental results.

• Korean Chemical Engineering Research
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• v.46 no.3
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• pp.550-554
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• 2008

The synthesis of dimethyl carbonate (DMC) from methanol and supercritical carbon dioxide over $K_2CO_3/ZrO_2$ catalysts have been studied. The catalysts were prepared by impregnating $ZrO_2$ with an aqueous $K_2CO_3$ solution. The optimum calcination temperature to disperse K species on the $ZrO_2$ surface was found to be 673 K. Monoclinic $ZrO_2$ was not active, as itself, for the DMC production. However, when the $K_2CO_3$ was impregnated on the $ZrO_2$, the catalytic performance was improved. Besides the catalyst, $CH_3I$ was used as a promoter. The $CH_3I$ promoter as well as the $K_2CO_3/ZrO_2$ catalyst was found to take an important role to improve the production of DMC. The optimum quantities for the catalyst and the promoter were estimated. The effect of the catalyst and the promoter for the DMC synthesis from methanol and supercritical carbon dioxide was investigated and the reaction mechanism was proposed.

• Polymer(Korea)
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• v.25 no.6
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• pp.759-764
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• 2001

In order to obtain PEO with reduced crystallinity, novel PEO derivatives containing carbonate linkages in the main chain have been synthesized by the reaction of various molecular weight poly (ethylene glycol)s (PEGs) with dimethyl carbonate (DMC) in the presence of $H_2SO_4$ to yield methyl carbonate terminated PEGs, followed by condensation reaction under vacuum in the presence of titanium isopropoxide (TiP) catalyst. The number average molecular weight of PEGs used was in the range of 200 and 600 g/mol. The structure and compositions of the resulting polymers were characterized by $^1$H-NMR and $^{13}C-NMR$. Their thermal behavior and molecular weight were characterized by DSC/TGA and GPC, respectively.

• Korean Chemical Engineering Research
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• v.45 no.6
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• pp.554-559
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• 2007

In order to improve the reactivity for the direct synthesis of dimethyl carbonate (DMC) using methanol and carbon dioxide, the various additives were used in the DMC synthesis using $Ce_{0.8}Zr_{0.2}O_2$ catalyst, and then effect of the additives was investigated. The various additives were molecular sieves 3A and the compounds having the various functional groups such as sulfate, carbonate, nitrate and phosphate. As a result, the compound such as $K_2SO_4$ and $Na_2SO_4$ having sulfate group were the most effective additive among the various additives. When $K_2SO_4$ was used as an additive in the direct synthesis of DMC, the amount of DMC was about 0.91 mmol, which was the highest mount of DMC among using only-$Ce_{0.8}Zr_{0.2}O_2$ catalyst and the various additives.

• Transactions of the Korean Society of Automotive Engineers
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• v.8 no.2
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• pp.1-8
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• 2000

Recently, Our planet is faced with very serious problems related to the air pollution due to the exhaust emissions of the diesel engine. So, lots of researchers have studied to reduce the exhaust emissions of diesel engine that influenced the environment strong. But most researchers have mainly studied and suggested the solution of reduction on the total exhaust emissions of diesel engine. In this study, the quantities of the low and high hydrocarbon among the exhaust emissions in diesel engine have been investigated by the quantitative analysis of the hydrocarbon C1~C6 using the gas chromatography. This study carried out by comparing the chromatograms with diesel fuel and mixed fuel which are blended the diesel and DMC(dimethyl carbonate)that includes the oxygen of about 53%. The results of this study show that the hydrocarbon C1~C6 among the exhaust emissions of the mixed fuel are exhausted lower than those of the diesel fuel at the all load.

• Korean Chemical Engineering Research
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• v.50 no.2
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• pp.217-222
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• 2012

The synthesis of dimethyl carbonate(DMC) is a promising reaction for the use of naturally abundant carbon dioxide. DMC has gained considerable interest owing to its versatile chemical reactivity and unique properties such as high oxygen content, low toxicity, and excellent biodegradability. In this study, the synthesis of DMC through the transesterification of ethylene carbonate(EC) with methanol was investigated by using ionic liquid and metal oxide catalysts. The screening test of different catalysts revealed that choline hydroxide ([Choline][OH]) and 1-n-butyl-3-methyl imidazolium hydroxide([BMIm][OH]) had better catalytic performance than metal salts catalysts such as MgO, ZnO and CaO. The effects of reaction parameters such as reaction temperature, MeOH/EC mole ratio, and carbon dioxide pressure on the reactivity of [Choline][OH] catalyst were discussed. High temperature and high MeOH/EC mole ratio were favorable for high conversion of EC. However, the yield of DMC showed a maximum when carbon dioxide pressure was 1.34 MPa, and then it decreased for higher carbon dioxide pressure. Zinc chloride($ZnCl_2$) was used as co-catalyst with the ionic liquid catalyst. The mixed catalyst showed a synergy effect on the EC conversion and DMC yield probably due to the acid-base properties of the catalysts.

• Clean Technology
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• v.22 no.3
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• pp.196-202
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• 2016

In this study, ceria- based catalysts were prepared for dimethyl carbonate (DMC) synthesis and reaction conditions were evaluated for finding the optimal reaction route. In order to find optimal catalysts for DMC synthesis, calcination temperature and Cu(II) impregnation amount were evaluated. The oxidative carbonylation using methanol, carbon monoxide and oxygen and the direct synthesis using methanol and carbon dioxide were introduced for producing DMC. Following the law of Le Chatelier, the dehydration reaction was applied for enhancing the reactivity (methanol conversion) as removing water during the reaction. 2-cyanopyridine, as a chemical dehydration agent, was used. In the case of the oxidative carbonylation, methanol conversion rate increased from 15.1% to 38.7% and the DMC selectivity increased from 0% to 98.8%. In the case of the direct synthesis, methanol conversion rate increased from 1.0% to 77.8% and the DMC selectivity increased from 41.2% to 100.0%.

• Clean Technology
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• v.11 no.4
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• pp.165-170
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• 2005

The aim of this study is to provide vapor-liquid equilibrium (VLE) information for the study of process which directly synthesize dimethyl carbonate (DMC) from $CO_2$. For this study we collected some necessary VLE systems data of Methanol-Water, Methanol-DMC, $CO_2$-DMC, $CO_2$-Methanol, $CO_2$-Methanol, and performed VLE calculation with Peng-Robinson equation of state, Wong-Sandler mixing rules that widely used in chemical industry. These calculation results relatively agreed with VLE data well. Optimized Parameters of EoS given through this calculation will be used as some valuable information for fundamental study, process development and process optimization of DMC direct synthesis.

• Korean Chemical Engineering Research
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• v.49 no.6
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• pp.732-738
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• 2011

Effect of metal oxide catalysts and ionic liquids on the synthesis of methyl carbamate(MC) and dimethyl carbonate (DMC) from urea and methanol was investigated in a high pressure reaction system. In closed system, MC yield from urea and methanol reached almost 100% at reaction temperature over $150^{\circ}C$ without catalyst, whereas DMC yield of 1.5% under was obtained irrespective of catalysts used. In DMC synthesis from MC and methanol, $ZnCl_{2}$ showed the highest catalytic activity and led to the DMC yield of 16.3% under optimal conditions. Furthermore, DMC yield can be enhanced by the simultaneous application of ionic liquids with nano-sized catalysts in semi-continuous reaction system.