• Title/Summary/Keyword: Reaction Oxygen

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Zeolite-catalyzed Isomerization of 1-Hexene to trans-2-Hexene: An ONIOM Study

  • Li, Yan-Feng;Zhu, Ji-Qin;Liu, Hui;He, Peng;Wang, Peng;Tian, Hui-Ping
    • Bulletin of the Korean Chemical Society
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    • v.32 no.6
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    • pp.1851-1858
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    • 2011
  • Details of the double-bond isomerization of 1-hexene over H-ZSM-5 were clarified using density functional theory. It is found that the reaction proceeds by a mechanism which involves the Br${\o}$nsted acid part of the zeolite solely. According to this mechanism, 1-hexene is first physically adsorbed on the acidic site, and then, the acidic proton transfers to one carbon atom of the double bond, while the other carbon atom of the double bond bonds with the Br${\o}$nsted host oxygen, yielding a stable alkoxy intermediate. Thereafter, the Br${\o}$nsted host oxygen abstracts a hydrogen atom from the $C_6H_{13}$ fragment and the C-O bond is broken, restoring the acidic site and yielding trans-2-hexene. The calculated activation barrier is 12.65 kcal/mol, which is in good agreement with the experimental value. These results well explain the energetic aspects during the course of double-bond isomerization and extend the understanding of the nature of the zeolite active sites.

Effects of Reactant Gas Flow Rates and Starvation on Phosphoric Acid Fuel Cell Performance (인산형 연료전지 발전성능에 미치는 반응기체 공급량 및 공급중단의 영향)

  • Song, Rak-Hyun;Kim, Chang-Soo;Choi, Byung-Woo;Choi, Soo-Hyun;Shin, Dong-Ryul
    • Proceedings of the KIEE Conference
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    • 1992.07b
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    • pp.662-665
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    • 1992
  • Effects of reactant gas flow rates and starvation on phosphoric acid fuel cell performance were studied. As the reactant gas flow rates increased, the cell performance increased and then the cell maintained constant performance. The optimum flow rates of hydrogen, oxygen and air under galvanostatic condition of 150 mA/$\textrm{cm}^2$ are found to be 3cc/min${\cdot}\textrm{cm}^2$, 4cc/min${\cdot}\textrm{cm}^2$, and 15cc/min${\cdot}\textrm{cm}^2$, respectively. Hydrogen and oxygen starvation resulted in voltage loss of about 5mV and 0-2mV, respectively. The voltage loss was independent of starvation time. These results were discussed from the point of view of electrochemical reaction of the cell.

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Synthesis of microporous carbons containing multi-functional groups and their electrochemical performance (다중 기능성 그룹을 포함하는 마이크로포어 탄소의 합성 및 전기화학적 특성)

  • Kim, Ki-Seok;Park, Soo-Jin
    • 한국신재생에너지학회:학술대회논문집
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    • 2011.05a
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    • pp.94.2-94.2
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    • 2011
  • In this work, multi-functional groups, i.e., nitrogen and oxygen, contained microporous carbons (MF-MCs) were prepared by the one step carbonization of the poly(vinylidene chloride-co-acrylonitrile-co-methyl methacryalte) (PVDC-AN-MMA) without activation. The electrochemical performance of MF-MCs was investigated as a function of carbonization temperature. It was found that MF-MCs had a high specific surface area over $800m^2/g$ without additional activation, resulting from the micropore's formation by the release of chlorine groups. In addition, although functional groups decreased, specific surface area was increased with increasing carbonization temperature, leading to the enhanced electrochemical performance. The pore size of the carbon distributed mainly in small micropore of 1.5 to 2 nm, which was idal for aqueous electrolyte. Indeed, the unique microstructure features, i.e. high specific surface area and optimized pore size provided high energy storage capability of MF-MCs. These results indicated that the microporous features of MF-MCs lead to feasible electron transfer during charge/discharge duration and the presence of nitrogen and oxygen groups on the MF-MCs electrode led to a pseudocapacitive reaction.

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Study of $Pr_{0.3}Sr_{0.7}CO_{x}Fe_{(1-x)}O_{3-\delta}$ (x=0, 0.3, 0.5, 0.7, 1) as the cathode materials for intermediate temperature SOFC (${\cdot}$저온형 고체 산화물 연료전지의 공기극 물질로 사용되는 $Pr_{0.3}Sr_{0.7}CO_{x}Fe_{(1-x)}O_{3-\delta}$ (x=0, 0.3, 0.5, 0.7, 1) 에 관한 연구)

  • Park, Kwang-Jin;Kim, Jung-Hyun;Lee, Chang-Bo;Bae, Joong-Myeon
    • 한국신재생에너지학회:학술대회논문집
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    • 2007.06a
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    • pp.125-128
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    • 2007
  • The influence of Co substitution in B-site at perovskite PSCF($Pr_{0.3}Sr_{0.7}CO_{x}Fe_{(1-x)}O_{3}$) was investigated in this study. The PSCF series exhibits excellent MIEC(mixed ionic electronic conductor) properties. ASR(area specific resistance) of PSCF3737 was 0.137 ${\Omega}{\cdot}cm^{2}$ at $700^{\circ}C$. The activation energy of PSCF3737 was also lower than other compositions of PSCF. ASR of PSCF3737 was analysed as two parts at different part of frequency region. Responses at middle frequency part (${\sim}10^2$ Hz) were concerned with oxygen reduction reaction and those at low frequency part (${\sim}10^{-1}$ Hz) were related with oxygen diffusion.

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Epitaxial growth of silicon thin films on insulating ($CeO_2$/Si) substrates (절연체 ($CeO_2$/Si)위에 성장된 실리콘 박막의 특성 연구)

  • 양지훈;문병식;김관표;김종걸;정동근;노용한;박종윤
    • Journal of the Korean Vacuum Society
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    • v.8 no.3B
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    • pp.322-326
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    • 1999
  • We have investigated the growing process of a silicon film on the $CeO_2/Si$ surface. The silicon was deposited by using electron beam deposition method. The $CeO_2$(111) film was grown on a (111)-oriented silicon substrate at $700^{\circ}C$ at oxygen [partial pressure of $5\times10^{-5}$ Torr. To investigate the condition of epitaxial growth of si films on the $CeO_2/Si$ substrate, we deposited Si at various temperature니 The overlayer silicon was characterized by using x-ray diffraction(XRD). double crystal x-ray diffraction (DCXRD), and transmission electron microscopy (TEM). At temperature higher than $690^{\circ}C$, $CeO_2$ layer was observed at the $CeO_2/Si$ interface, which was formed by chemical reaction with silicon and oxygen dissociated from $CeO_2$. When silicon was deposited on the $CeO_2/Si$ at $620^{\circ}C$, silicon grew epitaxially along the (111)-direction.

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Effects of Oxidation Reduction Potential and Organic Compounds on Anammox Reaction in Batch Cultures

  • Viet, Truong Nguyen;Behera, Shishir Kumar;Kim, Ji-Won;Park, Hung-Suck
    • Environmental Engineering Research
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    • v.13 no.4
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    • pp.210-215
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    • 2008
  • The present study investigates the effect of oxidation-reduction potential (ORP) and organic compounds on specific anaerobic ammonium oxidation activity (SAA) using batch experiments. The batch tests were based on the measurement of nitrogen gas production. The relationship between ORP and dissolved oxygen (DO) concentration was found to be ORP (mV) = 160.38 + 68 log [$O_2$], where [$O_2$] is the DO concentration in mg/L. The linear relationship obtained between ORP and SAA ($R^2$ = 0.99) clearly demonstrated that ORP can be employed as an operational parameter in the Anammox process. At ORP value of -110 mV, the SAA was $0.272{\pm}0.03\;g\;N_2-N\;(g\;VSS)^{-1}\;d^{-1}$. The investigation also revealed inhibitory effect of glucose on the SAA while acetate concentration up to 640 mg COD/L (corresponding to 10 mM) had stimulating effect on the SAA. However, acetate concentration beyond 640 mg COD/L had inhibitory effect on the Anammox activity. The results indicated that nitrogen rich wastewaters containing low level organic matter could be better treated by Anammox microorganisms in real-world conditions after some acidification process.

An Experimental Study on the Characteristics of Oxygen Combustion of Pulverized Coal and the $NO_x$ Formation using TGA/DSC and DTF (TGA/DSC, DTF를 이용한 미분탄의 산소 연소 및 $NO_x$ 배출 특성에 관한 실험적 연구)

  • Lee, Dae-Keun;Seo, Dong-Myung;Noh, Dong-Soon;Ko, Chang-Bog
    • 한국연소학회:학술대회논문집
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    • 2007.05a
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    • pp.54-59
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    • 2007
  • In a view of capturing $CO_2$ as a greenhouse gas, an experimental study was conducted on the combustion characteristics of pulverized coal in $O_2$/$CO_2$ environment using TGA/DSC and DTF facilities. The effects of gas composition and concentration on the processes of devolatilization and char burning experienced by coal particles in combustion furnace and on the concentration of products such as $CO_2$, CO and $NO_x$ were observed using TGA/DSC and DTF respectively. As results, it were found that the rate of devolitilation is nearly independent on the $O_2$ concentration if it is over 20% but the char burning rate is a sensitive function of $O_2$ percent, and the two rates can be controlled by $O_2$ concentration in order to be similar with those of air combustion case. It was also found that high concentration $CO_2$ can be captured by oxy-coal combustion and high concentration of CO and low value of $NO_x$ are exhausted in that case. Additionally, NO reducing reaction by CO with char as catalyst was observed and a meaningful results were obtained.

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Characteristics of Hydrogen Production from Methanol and Ethanol Using Plasma Reactor and Ozone Decomposition Catalyst (플라즈마 리액터 및 오존분해 촉매를 이용한 메탄올 및 에탄올로부터 수소발생특성)

  • Koo, Bon-Kook;Kim, Yong-Chun;Jang, Mun-Gug;Kim, Jong-Hyun;Park, Jae-Youn;Han, Sang-Bo
    • Journal of the Korean Institute of Illuminating and Electrical Installation Engineers
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    • v.25 no.10
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    • pp.116-124
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    • 2011
  • In this work, the effect of the initial concentration of methanol and ethanol, and the addition of oxygen molecules were discussed to improve the hydrogen generation using non-thermal plasma reactor effectively. In addition, the effect of ozone decomposition catalyst of manganese dioxide and its quantity was investigated. First, hydrogen concentration increased until an initial concentration of about 40,000[ppm] of methanol and thereafter it was saturated. Henceforth, hydrogen concentration decreased with increasing the oxygen percent on the carrier gas of nitrogen about both substances. Related with the effect of catalyst, it increased upto 60[g], but it was not changed largely after that. Consequently, it is confirmed that the hybrid process using plasma process and catalytic surface chemical reaction is a very promising way to increase the efficiency of hydrogen generation as investigated in this work.

Leaching Mechanism and Modelling of U$O_2$ Pellets (U$O_2$ Pellet의 침출거동 및 Modelling)

  • Chang, Kil-Sang;Chun, Kwan-Sik;Park, Hyun-Soo;Suh, In-Suk
    • Nuclear Engineering and Technology
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    • v.20 no.3
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    • pp.155-164
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    • 1988
  • A rate equation for UO$_2$ pellet leaching has been derived and compared with some experimental results. The leach rate model comprises the processes of oxygen penetration into UO$_2$ pellets and the dissolution and transport of oxidized UO$_2$ depending on the penetration depth of oxygen. The model may be analyzed with two regions of transient and steady state behaviors, which should depend on the initial oxidation state of pellets. Also this model can be utilized in the analyses of general leach processes if the oxidation reaction of UO$_2$ is replaced with similar mechanism of those processes.

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Effect of Copper ion on Xanthine Oxidase Activity and Type Conversion (Xanthine oxidase 활성 및 형전환에 미치는 구리이온의 영향)

  • Huh, Keun;Lee, Sang-Il;Park, Jeen-Woo
    • YAKHAK HOEJI
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    • v.38 no.2
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    • pp.211-217
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    • 1994
  • Copper intoxication and disturbance of copper metabolism induced various oxygen-derived free radicals related damages. The effect of copper ion on xanthine oxidase activity and type conversion of the enzyme which is concerned to generation of reactive oxygen species, was investigated, It was observed that xanthine oxidase activity was increased by addition of copper ion in the reaction mixture in proportional to the concentration of the metal ion until $60\;{\mu}M$, while the enzyme activity was inhibited in higher concentration of copper treatment. On the other hand, xanthine dehydrogenase activity was inhibited by copper ion addition with concentration dependently. Preincubation of enzyme source with $30\;{\mu}M$ of copper ion, which concentration marked increased the xanthine oxidase activity, unchanged the enzyme activity and type conversion compare to control in vitro system. It was also observed that copper induced xanthine oxidase activity and the enzyme type conversion was protected by dithiothreitol and penicillamine. These results indicate that the increment of the type conversion of xanthine oxidase necessarilly need the presence of copper ion in enzyme assay system.

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