• Title/Summary/Keyword: 화학 평형 이동

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Development of a Computer Code for Analyzing Time-dependent Nuclides Concentrations in the Multi-stage Continuous HLW Processing System (I) - Equilibrium Steady State - (다단계 연속후처리를 포함하는 핵주기공정의 핵종농도 동적분포 해석코드 계발(I) -정상 평형상태 해석모델-)

  • Oh, Se-Kee
    • Proceedings of the KIEE Conference
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    • 2000.11a
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    • pp.262-264
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    • 2000
  • 원자로 내에서 연소 중인 핵연료나 저장 또는 재처리 중인 사용후핵연료의 성분으로서 시설의 공정설계, 안전성분석 및 차폐설계에 중요한 입력자료가 되는 핵분열생성물질, 방사화생성물 및 악티나이드의 핵종 농도와 이에 대응하는 방사능 강도의 기기 별 시간변 화율을 해석할 수 있는 코드 개발할 목적으로 MULTISAMS 정상 평형상태 모델을 구현하였다. MULTISAMS 코드의 반응공정 모델은 서로 연결되어 있으며 내부에 방사성물질의 혼합유체가 순환하는 세 종류의 반응기(원자로, 열교환기 및 화학반응기) 계통에서 자연적 또는 설계에 의해 일어나는 현상으로서; 반응기 간의 물질 흐름; 각 반응기 내에서 방사성 붕괴, 변환, 이동과 중성자 흡수 및 핵분열; 외부로부터 특정 핵종의 유입혹은 유출을 고려한 시간종속 핵종농도보존방정식 이론에 근거한다. 코드의 유용성 및 신뢰성을 검증하기 위해 현재 개념설계가 진행 중인 AMBIDEXTER원자력 에너지시스템을 대상으로 ORIGEN2 계산과 비교하였다. 두 코드 간의 입력조건과 배경이론차이점 때문에 절대적 비교가 불가능하므로 단순이론의 중간매개코드로서 SAMS를 이용한 2단계 비교방법을 따랐다. 결론은 MULTISAMS는 ORIGEN2 계산의 수렴치와 근사하게 일치하면서 ORIGEN2 가 다룰 수 없는 핵주기 연속후처리공정의 정상가동 시 핵종 평형농도를 기기 별로 계산할 수 있다는 장점을 확인하였다.

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Synthesis and Electrochemical Characteristics of Rare Earths Metal Complexes (희토류금속 착물의 합성과 전기화학적 특성)

  • Chil Nam Choe;Suk Jin Yuon;Il Du Kim;Sung Pyung Kim;Youn Soo Sohn
    • Journal of the Korean Chemical Society
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    • v.33 no.5
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    • pp.496-503
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    • 1989
  • The chemical behavior of trivalent lanthanide (Pr(III) and Yb(III)) and 2, 2, 6, 6-tetramethyl-3, 5-heptanedione(dipivaloylmethane) complexes was investigated by the use of direct current, differential pulse polarography and cyclic voltammetry. In this study, it was founded that the reduction of trivalent lanthanide complexes was observed by one electron transfer process at Epc = -0. 13 V and -0.80 V of Pr(III), and -0.02 V of Yb(III) vs. Ag-AgCl electrode. Also, it was founded that the treatment of DP and CV to the case of a first-order chemical equilibrium reaction preceding a reversible and irreversible one electron transfer reaction, (a >0. 5) the socalled ErCr electrode process. The equilibrium constant (lnK) obtained, of various solvents, these constant were founded to be increases with decreasing dielectric constant of the solvents. Plots of lnK for these reaction against ln(l/D) for the solvents was fairly straight lines, and the behavior of the heavier lanthanides was decreased equilibrium constant with increasing atomic number.

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Nonlinear Adsorption Isotherm of Single and Multi-Components of 2'-Deoxyribonucleosides (2'-deoxyribonucleosides의 단일 및 다성분계의 비선형 흡착평형식)

  • Jin, Long Mei;Han, Soon Koo;Choi, Dae-Ki;Row, Kyung Ho
    • Korean Chemical Engineering Research
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    • v.43 no.2
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    • pp.230-235
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    • 2005
  • Reversed-phase high-performance liquid chromatography (RP-HPLC) was used to determine the equilibrium isotherm of single and multi-components of dUrd(2'-deoxyuridine), dGuo(2'-deoxyguanosine), and dAdo(2'-deoxyadenosine) of 2'-deoxyribonucleosides by dynamic method. The composition of mobile phase was 90/10 vol.% (water/MeOH). With an increase in the injection volumes, the retention times were shorter and the peak shapes were triangle-shaped, so Langmuir-type isotherm was assumed. The Langmuir adsorption parameters were estimated by PIM (pulsed-input method), and the competitive Langmuir adsorption isotherm was further utilized. For the sample of the dUrd and dGuo whose retention times were relatively short, the agreement of between the calculated value and experimental data was fairly good in both single and multi-components, but for the dAdo, the last eluting component, some deviations were caused by non-linear and non-ideal properties.

The Effects of Charge Transfer Complex on the Reaction of Aniline and Iodine (Aniline과 Iodine간의 반응에 있어서 전하이동 착물의 영향)

  • Oh-Yun Kwon;U-Hyon Paek;Eung-Ryul Kim
    • Journal of the Korean Chemical Society
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    • v.36 no.2
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    • pp.174-179
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    • 1992
  • Reaction of aniline and iodine in$CHCl_3,\;CH_2Cl_2 : CHCl_3$(1 : 1), and $CH_2Cl_2$ has been studied kinetically by using conductivity method, Pseudo first-order rate constants ($k_{obs}$) and second-order rate constants ($k_{obs}$/[aniline]) are dependent on the aniline concentration. Second-order rate constants obtained were increased with increasing aniline concentration. We analysed these results on the basis of formation of charge transfer complex as reaction intermediate. From the construction of react ion scheme and derivation of rate equation, we calculated equilibrium constants and activation parameters for the formation and transformation of charge transfer complex. The equilibrium constants were decreased by an increase in the dielectric constant of the solvent and the value is 1.7-3.7$M^{-1}$. The rate of transformation are markedly affected by the solvent polarity. ${\Delta}H^{\neq}$ is about 14.2kJ/mol, and ${\Delta}S^{\neq}$ is large negative value of -243J/mol K.

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The Physicochemical Properties on the Charge Transfer Complexes under High Pressure (고압하의 전하이동착물에 대한 물성론적 연구-사염화탄소 용액내에서 헥사메틸벤젠과 여러 전자받게들간의 전하이동착물 생성에 대한 압력과 온도의 영향)

  • Kwun Oh Cheun;Kim Myong Ja;Kim Se Kyung
    • Journal of the Korean Chemical Society
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    • v.35 no.4
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    • pp.335-342
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    • 1991
  • The effect of pressure and temperature on the stabilities of the charge transfer complexes of 1,3,5-trinitrobenzene, tetrachloro-p-benzoquinone and tetracyanoethylene with hexamethylbenzene in carbon tetrachloride has been investigated by spectrophotometric measurements. The equilibrium constants for the formation of the complexes were obtained at various temperature and pressure, and thermodynamic parameters for the formation of the charge transfer complexes are calculated from these values. The relative stabilities of charge transfer complexes with hexamethylbenzene increase in the order; 1,3,5-trinitrobenzene < tetrachloro-p-benzoquinone < tetracyanoethylene. This may be regarded as an order of relative acidity of these compounds in complexation with hexamethylbenzene and is explained in terms of the negative inductive effect of the ${\pi}$ acceptors. The red-shift at higher pressure, the blue-shift at higher temperature and the relation between pressure and oscillator strength are discussed on the basis of thermodynamic functions.

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A Thermodynamic Study on Thermochromism of Blue Dye Systems (Blue 계열 염료의 열변색 현상에 관한 열역학적 연구)

  • Kim, Jae-Uk;Ji, Myoung-Jin;Cha, Byung-Kwan;Kim, Jong-Gyu
    • Journal of the Korean Chemical Society
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    • v.54 no.5
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    • pp.500-505
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    • 2010
  • Two different dyes containing the same molecular weight but different chemical structure have been utilized for the study of thermodynamic parameters. In this study, {3-(4-(diethylamino)phenyl)-3-(1-ethyl-2-methyl-1H-indol-3-yl)isobenzofuran-1(3H)-one} (Blue 502) and {3-(4-(diethylamino)-2-methylphenyl)-3-(1,2-dimethyl-1H-indol-3-yl)isobenzofuran-1(3H)-one} (Blue 402) were used. It has been performed by measuring UV spectra of the two dyes. In general, the blue shift has been observed from both dyes in higher carbon number alcohol solvents. Interestingly, Blue 502 showed higher stability than Blue 402 in the same conditions used in this study. And, the equilibrium constants (0.9~1.0) of the dyes depending upon temperature change were also calculated using UV absorbance. The standard enthalpy calculated from equilibrium constants and molar absorptivity($\varepsilon$) are 10.94 kJ/mol in Blue 402 and 9.010 kJ/mol in Blue 502, respectively.

Separation of Aromatics in Light Cycle Oil by Solvent Extraction - Re-extraction of Aromatics in Extract Phase - (용매 추출법에 의한 분해경유중의 방향족 분리 -추출상중의 방향족의 역수출-)

  • Kim, Su Jin;Kim, Duk-Hyun
    • Applied Chemistry for Engineering
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    • v.8 no.6
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    • pp.967-972
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    • 1997
  • Recovery of aromatics in extract phase which was obtained by batch equilibrium extraction between light cycle oil(LCO) and dimethylsulfoxide(DMSO) solution as solvent was investigated by re-extraction. To select the most suitable re-extraction solvent for recovery of aromatics in extract phase, distribution equilibrium was measured between extract phase and solvents. The solvents used were benzene(B), toluene(T), m-Xylene(mX), n-hexane(Hx) and n-hexane(Hx) and n-Octane(Ot). From the distribution coefficients and yields of aromatics, Hx seemed to be the most suitable. Furthermore, effects of operation parameters for re-extraction of aromatics in the extract phase were studied by batch equilibrium re-extracion with Hx as solvent. Yields of aromatics were found to increase with increasing solvent/feed (extract phase) mass ratio(S/F), while distribution coefficients of aromatics were fixed irrespective of S/F used. Operating temperature did not affect distribution coefficients and yields of aromatics. Distibution coefficients and yields of naphthalene group(carbon numer : 10~12) increased with increasing cabon number. Mass transfer rates of aromatics were also measured with a batch stirred vessel.

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A Research on the Conception Change Process of Secondary School Chemistry Major Teachers Related to the Evaporation Phenomena in the Air (대기 중의 증발 현상에 대한 중등학교 화학전공 교사들의 개념 변화 과정에 대한 연구)

  • Yang, Gee-Chang;Paik, Seoung-Hey
    • Journal of the Korean Chemical Society
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    • v.52 no.1
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    • pp.84-95
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    • 2008
  • In this study, preconceptions held by chemistry major secondary school science teachers were searched in relation to explanations of water evaporation phenomena with phase equilibrium diagrams. 25 chemistry major science teachers were selected to complete questionnaires developed in this study and 6 among of them were selected to participate in follow-up interviews. Among these, 10 participants were selected for an evaluation of the change of their preconceptions through lessons developed in this study. From the results, it was found that many teachers believed that the phase equilibrium diagram could not explain water evaporation phenomena. They also thought that there was no relation between vapor pressure and the vertical axis of the phase equilibrium diagram. However, after the lessons in earth science, they recognized that the vapor pressure curve of the phase equilibrium diagram could be explained by adopting a saturated vapor curve. Because they had known the process of application the conceptions of saturated situation, nonsaturated situation, process of equilibrium movement in saturated vapor curve. They could understand natural phenomena such as evaporation with the phase equilibrium diagram through a change in their conceptions as guided from science lessons integrating earth science and chemistry.

Characterization of Long-Range Transported Aerosols using Synchrotron XRF(X-Ray Fluorescence) (Synchrotron-XRF를 이용한 장거리 이동 대기에어로졸의 특성 분석)

  • ;;Steven S. Cliff;Michael Jimenez-Cruz;Kevin D. Perry;Thomas A. Cahill
    • Proceedings of the Korea Air Pollution Research Association Conference
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    • 2002.11a
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    • pp.360-361
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    • 2002
  • 대기 중의 에어로졸은 지구의 복사평형에 직·간접적으로 영향을 끼친다. 직접적인 영향으로는 에어로졸이 가시광선과 자외선 영역의 에너지를 산란 또는 흡수함으로써 기후에 영향을 미치며, 간접적으로는 microphysical process에 의한 구름의 특성을 변화시키거나 불균일적인 화학반응을 통해서 복사특성을 지니는 가스들을 변화시킴으로써 기후에 영향을 미친다. 또한 동북아 지역 및 인접한 태평양 지역은 중국과 인접해 있는 관계로 매년 봄철이민 고비사막이나 중국의 황토고원에서 발생한 황사(Asian Dust) 현상에 의해 많은 고통을 겪고 있다. (중략)

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A Kinetic Study of the Substitution of $\beta$-Disketone in Bis($\beta$-diketonato)Oxovanadium (IV) ((베타-디케토네이토) 옥소바나듐 (IV) 착물에서의 베타-디케톤 치환반응에 관한 속도론적 연구)

  • Hwang, Gyu Tak;Kim, Jeong Seong;Sin, Han Cheol;Kim, In Hwan;Kim, Gi Tae
    • Journal of the Korean Chemical Society
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    • v.34 no.4
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    • pp.319-324
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    • 1990
  • Kinetic of substitution of dibenzoylmethanate (dbm) for one acetylacetonate (acac) in VO (acac)$_2$ have been studied in various solvents by spectrophotometry. Under the condition [VO (acac)$_2$] 》[Hdbm], the rate law for the substitution reaction is expressed as, rate = k$_2$K[VO(acac)$_2$] [Hdbm] / (1 + K[VO(acac)$_2$]) where K = [VO (acac)$_2$dbmH] / [VO(acac)$_2$][Hdbm] and the rate constant k$_2$ corresponds to that of proton transfer from coordinated Hdbm to leaving acac- in VO(acac)$_2$dbmH.

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