• 제목/요약/키워드: Equilibrium reaction

검색결과 584건 처리시간 0.033초

미소 수용 Cyclohexange 중에서 분말 Lipase에 의한 분자내 에스테르화반응 (Intramolecular Esterification by Lipase Powder in Microaqueous Cycohexane)

  • 이민규;감삼규
    • 생명과학회지
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    • 제5권4호
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    • pp.155-161
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    • 1995
  • The effects of substrate concentration, enzyme concentration, reaction temperature, and water content were investigated in intramolecular esterification. This study used cyclohexane as organic solvent, power lipase as enzyme, and benzyl alcohol and octanoic acid as substrate. The initial reaction rate was found to be proportional to enzyme concentration; followed Michaelis-Menten equation for octanoic acid; and was inhibited by benzyl alcohol . The observed initial reaction rate first increased, then decreased with increasing reaction temperature, giving rise to the maximum rate at 20$\circ$. The drop in the reaction rate at higher temperature was to partition equilibrium change of substrate between organic solvent and hydration layer of enzyme molecule in addition to the deactivation by enzyme denaturation. Water layer surrounding enzyme molecule seemed to activate in organic solvent and the realistic reaction was done in the water layer. In the enzymatic reaction in organic solvent, the initial reaction rate was influenced by partition quilibrium of substrate, so the optimum condition of substrate concentration, enzyme concentration, reaction temperature, and water content would give a good design tool.

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Numerical Study of Chemical Performance of 30 tonf -class LRE Nozzle of KARI

  • Kang, Ki-Ha;Lee, Dae-Sung;Cho, Deok-Rae;Choi, H.S.;Choi, J.Y.
    • 한국추진공학회:학술대회논문집
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    • 한국추진공학회 2008년 영문 학술대회
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    • pp.448-451
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    • 2008
  • Three methods of nozzle flow analysis, frozen-equilibrium, shifting-equilibrium and non-equilibrium approaches, were used to rocket nozzle flow, those were coupled with the methods of computational fluid dynamics code. For a design of high temperature rocket nozzle, chemical equilibrium analysis which shares the same numerical characteristics with frozen flow analysis can be an efficient design tool for predicting maximum thermodynamic performance of the nozzle. Frozen fluid analysis presents the minimum performance of the nozzle because of no consideration for the energy recovery. On the other hand, the case of chemical-equilibrium analysis is able to forecast the maximum performance of the nozzle due to consideration for the energy recovery that is produced for the fast reaction velocity compared with velocity of moving fluid. In this study, using the chemical equilibrium flow analysis code that is combined the modified frozen-equilibrium and the chemical-equilibrium. In order to understand the thermochemical characteristic components and the accompanying energy recovery, shifting-equilibrium flow analysis was carried out for the 30 $ton_f$-class KARI liquid rocket engine nozzle together with frozen flow. The performance evaluation based on the 30 $ton_f$-class KARI LRE nozzle flow analyses will provide an understanding of the thermochemical process in the nozzle and performances of nozzle.

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PATTERN FORMATION IN A GENERAL DEGN-HARRISON REACTION MODEL

  • Zhou, Jun
    • 대한수학회보
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    • 제54권2호
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    • pp.655-666
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    • 2017
  • In this paper, we study the pattern formation to a general Degn-Harrison reaction model. We show Turing instability happens by analyzing the stability of the unique positive equilibrium with respect to the PDE model and the corresponding ODE model, which indicate the existence of the non-constant steady state solutions. We also show the existence periodic solutions of the PDE model and the ODE model by using Hopf bifurcation theory. Numerical simulations are presented to verify and illustrate the theoretical results.

A GRAPHICAL ALGORITHM FOR CALCULATING THE RANKS OF COMPLEX REACTION NETWORKS

  • Choo, S.M.;Lee, N.Y.
    • Journal of applied mathematics & informatics
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    • 제30권5_6호
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    • pp.787-792
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    • 2012
  • We present a graphical algorithm and theorems for calculating the ranks of reaction networks. The ranks are needed to study behaviors of the networks from their structures. This approach can graphically simplify complex networks for the calculation. We show an example of a large network for the practical advantage.

탄소연료를 이용하는 고체 산화물 연료전지의 연료극 반응 수치해석 (Numerical Modeling of Anodic Reaction of Carbon-Rich Fuel at Solid Oxide Fuel Cell)

  • 임호;김종필;송주헌;장영준;전충환
    • 에너지공학
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    • 제19권3호
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    • pp.188-194
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    • 2010
  • DCFC는 가스 터빈이나 엔진과 달리 탄소를 사용하여 전기화학반응을 통해 직접 전기를 생산하는 연료전지이며, 주요 특징으로 기존의 발전설비 보다 높은 효율과 낮은 배기 배출물을 발생한다. 본 연구에서는 간단한 열역학 평형 해석을 통해 CO와 $CO_2$가 이론 기전력에 미치는 영향을 확인하였으며, 2차원 CFD 해석 방법을 이용하여 온도에 따른 반응 생성물 변화를 살펴보았다. 그 결과, CO 생성 반응(Boudouard 반응)을 동시에 고려한 이론 기전력 값은 $CO_2$ 생성 반응만 고려한 값(약 1.02 V)보다 크며, 특히 온도가 증가할수록 그 값이 증가함을 보여주었다. 2차원 수치해석 결과를 통하여서 Boudouard 반응이 고온으로 갈수록 중요하며, 비활성 기체로 인하여 Boudouard 반응이 지연됨을 확인하였다.

고급강 제조 반응 모델의 검토 : Part. 2. 종합 모델 및 단일 반응 모델 (A Review of Kinetic Model for Production of Highgrade Steel : Part. 2. Complex Reaction Model and Single Reaction Model)

  • 김정인;김선중
    • 자원리싸이클링
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    • 제30권1호
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    • pp.14-25
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    • 2021
  • 고품질 철강의 수요가 증가함에 따라 2차 정련 공정의 중요성이 높아지고 있다. 하지만 공정 시간에 따라 변화하는 용강, 슬래그 및 비금속 개재물의 조성은 정련 공정이 평형 상태가 아님을 의미하며, 정련 공정에서는 용강, 슬래그, 비금속 개재물, 내화물 및 합금 원소 간의 동시 다발적 반응이 일어난다. 다양한 상들의 비평형 상태에서 복잡한 반응을 고려하기 위해, 이전 연구자들은 실험을 통해 도출된 반응 속도 수식들을 기반으로 kinetic 기반의 고급강 제조 정련 시뮬레이션 모델을 발표하였다. 정밀한 시뮬레이션 모델의 개발을 위해 보고된 2차 정련 모델들의 분석 및 검토가 필요하다. 본 연구에서는 국내외로 발표된 정련 공정 관련 종합 모델들 및 단일 반응 모델들에 대하여 검토하고 소개하였다.

순수 산소계의 주간 및 야간 광화학반응 (Daytime and Nighttime Photochemical Reactions of the Pure Oxygen System)

  • 윤광식
    • 대한화학회지
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    • 제13권4호
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    • pp.249-261
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    • 1969
  • Studies of photochemical reactions of the pure oxygen atmosphere are made using reaction rate constants and atmospheric data available in the latest literature. The daytime and nighttime variations in atomic oxygen and ozone are computed, based on three different conditions: 1) photochemical equilibrium, 2) direct integrations of the rate equations with modifications and approximation to the equations, and 3) by numerical integrations. The departure from the photochemical equilibrium concentrations during day and nighttime are discussed by comparing the results obtaind from the three conditions.

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Hydroperoxide 의존성 반응에서의 Cytochrome P-450의 산화활성종 형성양식 (Mechanism of Peroxide-supported Hydroxylation by Cytochrome P-450 : Its Formation Pattern of the Active Intermediate)

  • 문전옥;김기헌
    • 약학회지
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    • 제37권1호
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    • pp.95-99
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    • 1993
  • Peroxidase activity of cytochrome P-450 was examined using N, N-dimethylaniline (NDA) as a substrate and cumene hydroperoxide (CHP) as an oxidant. The initial rates of the N-demethylation for varied concentrations of NDA (0.05-0.5 mM) by P-450 at different fixed concentrations of CHP (0.02-0.2 mM) were determined. The results suggest that P-450 proceeds its peroxidative reaction by the rapid equilibrium random bi bi mechanism to form a ternary complex with substrate and oxidant as an active intermediate.

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수첨탈황과 탈질반응에서 Thiophene과 Pyridine의 상호영향과 그 속도론적 해석 (Interactions between Hydrodesulfurization of Thiophene and Hydrodenitrogenation of Pyridine and the Kinetic Analysis)

  • 박종희;한창훈;김경림
    • 한국대기환경학회지
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    • 제4권1호
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    • pp.13-22
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    • 1988
  • Interactions between hydrodesulfurization of thiophene and hydrodenitrogenation of pyridine and the kinetic analysis were studied over $Ni-W/\gamma-Al_2O_3$ catalysts and this study was made at temperatures ranging from 473-673 K and at total pressures ranging from 10-25 $\times 10^5$ Pa. Hydrodesulfurization of thiophene was inhibited by presence of pyridine at all temperatures studied, and the rate of pyridine hydrodenitrogenation was slower than that of thiophene hydrodesulfurization in the operating conditions. Pyridine hydrodenitrogenation was also inhibited by the presence of thiophene at low temperatures but was enhanced by the thiophene at temperatures higher than 613K. Thiophene reaction rate was determined by multiple linear regression analysis using Langmuir-Hinshelwood-Hougen-Watson model and the result was given to be $r = kP_T^p_H/(1+K_Tp_T+K_Pp_P)^2$. At each temperature, reaction rate constants and absorption equilibrium equilibrium constants were determined and the activation energy was 12.98 kcal/gmol from Arrhenius plot.

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생전분을 당공여체로 한 분쇄마찰매체 함유 효소반응계에서의 Stevioside의 당전이 반응 기작 (Reaction Mechanism of Transglycosylation of Stevioside in the Attrition Coupled Reaction System Using Raw Starch as a Glycosyl Donor)

  • 백승걸;박동찬;허태린;이용현
    • 한국미생물·생명공학회지
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    • 제22권3호
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    • pp.252-258
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    • 1994
  • Transglycosylation of stevioside in the attrition coupled heterogeneous reaction system using raw starch as a glycosyl donor has significant advantages over conventional reaction systems using liquefied starch as a donor. The transglycosylation of stevioside under the presence of organic solvent showed that transglycosylation reaction occurs via two steps ; initially from raw starch to cyclodextrin(CD), and then followed by transglycosylation of produced CD. Comparison of the transglycosylation efficiency of c$\alpha $-, $\beta $, $\gamma $-CDs indicated that $\alpha $-, $\beta $-CD are mainly utilized as a glycosyl donor for following reaction. The reaction mechanism of transglycosylation between stevioside and CD proceeded according to random sequential bireactant mechanism. The equilibrium constant of transglycosylation reaction of cyclodextrin glucanotransferase wase also evaluated. The structure of transglycosylated stevioside was confirmed by TLC, and it was found that glycosyl group(G$_{1}, $ ~ G$_{4}$-glycosidic bond.

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