• 한국전산유체공학회:학술대회논문집
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• 한국전산유체공학회 2001년도 춘계 학술대회논문집
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• pp.144-148
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• 2001

Characteristics of high temperature rocket nozzle flow is discussed along with the aspects of computational analysis. Three methods of nozzle flow analysis, frozen-equilibrium, shifting-equilibrium and non-equilibrium approaches, were discussed those were coupled with the methods of computational fluid dynamics. A chemical equilibrium code developed for the analysis of general hydrocarbon fuel was coupled with three approaches of nozzle flow analysis, and a test was made for a bell nozzle at typical operation condition. As a results, the characteristics of the approaches were discussed in aspects of rocket performance, thermal analysis and computational efficiency.

• 방사성폐기물학회지
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• 제19권2호
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• pp.187-196
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• 2021

Chemical equilibrium calculations for multicomponent aqueous systems involving the reductive dissolution of magnetite (Fe₃O₄) with oxalic acid (H₂C₂O₄) were performed using the HSC Chemistry® version 9. They were conducted with an aqueous solution model based on the Pitzer's approach of one molality aqueous solution. The change in the amounts and activity coefficients of species and ions involved in the reactions as well as the solution pH at equilibrium was calculated while changing the amounts of raw materials (Fe₃O₄ and H₂C₂O₄) and the system temperature from 25℃ to 125℃. In particular, the conditions under which Fe₃O₄ is completely dissolved at high temperatures were determined by varying the raw amount of H₂C₂O₄ and the temperature for a given raw amount of Fe₃O₄ fed into the aqueous solution. When the raw amount of H₂C₂O₄ added was small for a given raw amount of Fe₃O₄, no undissolved Fe₃O₄ was present in the solution and the pH of the solution increased significantly. The formation of ferrous oxalate complex (FeC₂O₄) was observed. The equilibrium amount of FeC₂O₄ decreased as the raw amount of H₂C₂O₄ increased.

• 한국추진공학회:학술대회논문집
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• 한국추진공학회 2007년도 제29회 추계학술대회논문집
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• pp.105-109
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• 2007

로켓 노즐 유동해석에는, 전산 유체 역학 코드와 결합된 동결 유동 해석, 화학 평형 해석, 화학 비평형 해석이 사용되어진다. 고온 로켓 엔진 노즐의 설계에서, 동결 유동 해법과 동일한 수치적 특징을 가지는 화학평형 해석은 노즐의 열역학적 최대 성능을 예측하는 효율적인 설계 도구가 될 수 있다. 본 연구에서는 30톤급 KARI 액체 로켓 엔진 노즐에 대하여 동결유동 해석 및 화학평형 유동 해석을 수행하였다. 유동 해석 결과에 기초한 30톤급 KARI 액체 로켓 엔진 성능 평가는 노즐에서의 열화학적 특성에 대한 이해와 노즐의 성능을 제공할 것이다.

• Korean Chemical Engineering Research
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• 제56권2호
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• pp.222-228
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• 2018

석유화학산업의 대표적인 물질로 쓰이는 벤젠은 각종 화학 제품의 기초 물질이다. 그러나 일반적으로 벤젠은 석유화학 산업에서 순수 물질로 존재하지 못하고 알코올류와 벤젠 혼합물로 존재하게 된다. 또한 알코올을 한 성분으로 하는 혼합물은 공비 혼합물이 생성되기 때문에 분리 정제를 위해서는 상평형 데이터가 필수적이다. 본 연구에서는 알코올을 대표하는 1-프로판올을 사용하여 1-프로판올/벤젠 계에 대하여 재순환 평형장치를 이용하여 평형 온도/압력 효과에 따른 상평형 연구를 수행하였다. 측정된 기-액 평형 데이터는 UNIQUAC 식과 WILSON 식을 이용하여 상관관계 시키고 Gibbs/Duhem식을이용하여열역학적건전성을확인하였다. 상평형실험결과 RMSE (Root Mean Square Error)와 AAD (Average Absolute Deviation)는 두 모델식에서 0.05 이하의 값을 보여 실험값과 계산 값이 잘 일치함을 알 수 있었다. 또한 Gibbs/Duhem식을 이용하여 열역학적 건전성을 판별한 결과 잔류항 값이 ${\pm}0.2$ 이내에 분포하는 것을 통해 데이터에 대한 건전성을 확인할 수 있었다.

• Environmental Analysis Health and Toxicology
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• 제18권1호
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• pp.63-67
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• 2003

Benzoic acid is produced about 700 tons/year in Korea as of 1998 survey. Most is used as a stabilizer in the processes of synthesis of pharmaceuticals and dyes. It is also used for ingradient of paint, disinfections, and antifungals. Due to the antioxidant activity of benzoic acid, the chemical is also used as food preservatives. Although the chemical is widely used in Korea, exposure levels in air, water, soil or sediment have not been monitored or estimated so that risk evaluation of benzoic acid was not possible. In this study, distribution of the chemical among environmental media was estimated using EQC model based on the chemical-physical properties. In Level I and II of which the chemical are hypothesized in equilibrium and no transfer through the media, more than 93％ of benzoic acid are estimated to be distributed in water. However, in Level III of which non-equilibrium and intermedia transfer could be occurred, the chemical is estimated to distributed to soil, 64％ and water,35% as of total amount.

• Biotechnology and Bioprocess Engineering:BBE
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• 제11권1호
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• pp.61-66
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• 2006

The simple Langmuir isotherm is frequently employed to describe the equilibrium behavior of protein adsorption on a wide variety of adsorbents. The two adjustable parameters of the Langmuir isotherm - the saturation capacity, or $q_m$, and the dissociation constant, $K_d$ - are usually estimated by fitting the isotherm equation to the equilibrium data acquired from batch equilibration experiments. In this study, we have evaluated the possibility of estimating $q_m$ and $K_d$ for the adsorption of bovine serum albumin to a cation exchanger using batch kinetic data. A rate model predicated on the kinetic form of the Langmuir isotherm, with three adjustable parameters ($q_m,\;K_d$, and a rate constant), was fitted to a single kinetic profile. The value of $q_m$ determined as the result of this approach was quantitatively consistent with the $q_m$ value derived from the traditional batch equilibrium data. However, the $K_d$ value could not be retrieved from the kinetic profile, as the model fit proved insensitive to this parameter. Sensitivity analysis provided significant insight into the identifiability of the three model parameters.

• Bulletin of the Korean Chemical Society
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• 제25권2호
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• pp.321-324
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• 2004

• Bulletin of the Korean Chemical Society
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• 제19권5호
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• pp.591-593
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• 1998

• 한국항공우주학회지
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• 제34권7호
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• pp.89-96
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• 2006

액체 로켓의 가스발생기의 연소 온도는 터빈 깃의 열 손상을 방지하기 위하여 1,000K 이하로 유지되며 이를 위하여 농후 연소 또는 산화제 과다 연소를 유지한다. 이러한 이유로 연소는 비평형 화학반응이 주로 발생하며 연소반응을 예측하기가 매우 어렵다. 한편 케로신은 여러 가지 탄화수소 연료로 이루어진 혼합연료로 화학반응 메커니즘에 대한 모델이 매우 어려운 실정이다. 본 연구에서는 Dagaut가 개발한 207 화학종, 1592 화학반응 단계를 이용하였으며 완전혼합반응기 연소모델을 적용하여 계산하였다. 계산결과와 실험결과를 비교하여 보면 사용된 화학반응 기구가 검댕 예측을 하지 않고 있음에도 불구하고 계산 결과는 연소가스 온도 뿐 아니라 가스 물성치 등을 매우 잘 예측하고 있음을 확인하였다.

• Macromolecular Research
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• 제16권3호
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• pp.189-193
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• 2008

Thermal cross-linking method of poly(vinyl alcohol) (PVA) using poly(acrylic acid) (PAA) was carried out on PVA/PAA hydrogels. The level of gelation was measured in the PVA/PAA hydrogels with various PAA contents. The swelling behavior at various pHs showed that the swelling kinetics and water contents of the PVA/PAA hydrogels reached equilibrium after 30 h, and the time to reach the equilibrium state decreased with increasing PAA content in the hydrogel. The water content increased with increasing pH of the buffer solution. The permeation and release of the drug were tested using indomethacin as a model drug. The permeated and released amounts of the drug increased with decreasing the PAA content because of the low free volume in the hydrogel due to the higher cross-linking density. The kinetic profile of drug release at various pHs showed that all samples reached the equilibrium state within the 5 h.