• Bulletin of the Korean Chemical Society
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• 제21권10호
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• pp.957-958
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• 2000

The addition effect of $CH^3Br$ on the ignition of methane was investigated in the temperature range of 1537-1920 K behind reflected shock waves. The ignition delay times were measured by the sudden increase of pres-sure and OH emission in the $CH_4-O_2-Ar$ system containing small amount of $CH_3Br.$ The delay times of mix-tures with $CH_3Br$ were shorter than those without $CH_3Br.$ The promotion of ignition by $CH_3Br$ was caused by the relative fast decomposition rate in additive. To clarify the addition effect of $CH_3Br$ from the viewpoint of the reaction mechanism, computational analyses were performed in $CH_4-CH_3Br-O_2-Ar$ mixtures.

• 청정기술
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• 제16권3호
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• pp.198-205
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• 2010

염화탄화수소 열분해와 생성물분포 특성을 고찰하기 위해 등온 관형 반응기를 이용해 두 가지 실험을 수행하였다. 첫 번째는 반응분위기에 따른 열분해 특성을 파악하기 위해 $H_2$ 또는 Ar 반응분위기에서 dichloromethane ($CH_2Cl_2$) 분해율과 생성물분포 특성을 고찰하였다. Ar 반응분위기($CH_2Cl_2$/Ar 반응계)에서 보다 $H_2$ 반응분위기($CH_2Cl_2/H_2$ 반응계)에서 $CH_2Cl_2$ 분해율이 더 높았다. 이는 반응성 기체인 $H_2$ 분위기에서 $CH_2Cl_2$ 분해를 촉진시키며 수소 첨가 탈염소반응을 통해 탈염소화된 탄화수소화합물을 생성시키며, 다환방향족탄화수소 (polycyclic aromatic hydrocarbon: PAH)와 soot 생성을 억제하기 때문이다. $CH_2Cl_2/H_2$ 반응계에서 주요생성물로 탈염소화합물인 $CH_3Cl,\;CH_4,\;C_2H_6,\;C_2H_4,\;HCl$ 등이 생성되었으며, 미량 생성물로 chloroethylene이 검출되었다. $CH_2Cl_2$/Ar 반응계에서는 탄소물질수지가 낮았으며 특히 반응온도 $750^{\circ}C$ 이상에서 탄소물질 수지가 더 낮게 나타났다. 주요 생성물로는 chloroethylene과 HCl이 검출되었으며, 미량 생성물로는 $CH_3Cl$과 $C_2H_2$이 검출되었다. 고온 Ar 반응분위기에서 $CH_4$ 주입에 따른 chloroform($CHCl_3$) 분해와 생성물분포 특성을 비교 고찰하였다. $CHCl_3$ 분해율을 비교해 보면 $CH_4$을 주입할 경우($CHCl_3/CH_4/Ar$ 반응계)가 $CH_4$을 주입하지 않았을 경우($CHCl_3$/Ar 반응계)보다 분해율이 낮았다. 이는 $CHCl_3$가 분해되면서 생성되는 활성도가 큰 이중라디칼(diradical)인 :$CCl_2$가 첨가물로 주입된 $CH_4$와 반응하여 소모됨으로써 $CHCl_3$ 분해율이 상대적으로 감소되기 때문이다. Ar 반응분위기에서 $CH_4$ 첨가 여부에 따라 $CHCl_3$이 분해되면서 생성되는 생성물 분포는 큰 차이를 나타내고 있었다. 앞에서 고찰된 각 반응계에서 분해율 비교와 생성물 분포특성을 고려하고 열화학이론 및 반응속도론을 기초로 주요 반응경로를 제시하였다.

• Bulletin of the Korean Chemical Society
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• 제7권6호
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• pp.466-468
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• 1986

Reaction of $Ir(ClO_4)(CO)(PPh_3)_2$ with trans-$C_6H_5CH$ = $CHCO_2C_2H_5$ produces a new cationic iridium(I) complex, [Ir (trans-$C_6H_5CH$ = $CHCO_2C_2H_5)(CO)(PPh_3)_2]ClO_4$ where trans-$C_6H_5CH$ = $CHCO_2C_2H_5$ seems to be coordinated through the carbonyl oxygen rather than through the $\pi$-system of the olefinic group according to the spectral data. It has been found that Ir$(ClO_4)(CO)(PPh_3)_2$ catalyzes the hydrogenation of $CH_2$ = $CHCO_2C_2H_5$, trans-$CH_3CH$ = $CHCO_2C_2H_5$ and trans-$C_6H_5CH$ = $CHCO_2C_2H_5$ to $CH_3CH_2CO_2C_2H_5$, $CH_3CH_2CH_2CO_2C_2H_5$ and $C_6H_5CH_2CH_2CO_2C_2H_5$, respectively at room temperature under the atmospheric pressure of hydrogen. The relative rates of the hydrogenation of the unsaturated esters are mostly understood in terms of steric reasons.

• 대한화학회지
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• 제24권1호
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• pp.8-14
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• 1980

메틸클로로휘메이트, $CH_3O$(CO)Cl와 메틸티오노클로로휘메이트, $CH_3O$(CS)Cl 및 메틸티올클로로휘메이트, $CH_3S$(CO)Cl의 가용매분해반응속도상수를 아세톤-물 및 아세토니트릴-물혼합용매중에서 전기전도도법으로 측정했으며 활성화파라미터, ${\Delta}H^{\neq}$ 와 ${\Delta}S^{\neq}$를 구하였다. 그 결과로 물함량이 큰 영역에서는 속도순위가 $$CH_3O(CO)Cl 이며, 한편 dipolar aprotic solvent가 큰 부분에서는 속도의 순위가 거꾸로 임을 알았다. log k대 solvent parameter인 Y, $\frac{D-1}{2D+1}$ 와 log($H_2$) 의 plots는 물함량이 큰 부분에서 $S_N1$ 성격이 증가함을 보여준다. 물함량이 큰 영역에서 $CH_3O$(CO)Cl은 $S_N2$로 $CH_3O$(CS)Cl은 중간정도의 메카니즘으로 반응하나 $CH_3S$(CO)Cl은 $S_N1$ 메카니즘으로 반응함을 알았다.

• Bulletin of the Korean Chemical Society
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• 제23권6호
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• pp.811-817
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• 2002

Gibbs ensemble Monte Carlo simulations were performed to calculate the vapor-liquid coexistence properties for the binary mixtures $CO_2/CH_3OH$, $CO_2/C_2H_5OH$, and $CO_2/CH_3CH_2CH_2OH.$ The configurational bias Monte Carlo method was used in the simulation of alcohol. Density of the mixture, composition of the mixture, the pressure-composition diagram, and the radial distribution function were calculated at vapor-liquid equilibrium. The composition and the density of both vapor and liquid from simulation agree considerably well with the experimental values over a wide range of pressures. The radial distribution functions in the liquid mixtures show that $CO_2$ molecules interact more stogly with methyl group than methylene group of $C_2H_5OH$ and $CH_3CH_2CH_2OH$ due to the steric effects of the alcohol molecules.

• 한국재료학회지
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• 제21권4호
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• pp.207-211
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• 2011

Ni 8 wt.%-doped tin oxide ($SnO_2$) thick films were fabricated into gas sensors by the method of screen printing onto alumina substrates. The particle size of $SnO_2$ was controlled by changing the ball-mill time between 0~120 h. The structural and morphological properties of these thick films were investigated using X-ray diffraction and scanning electron microscopy. The structural properties of $SnO_2$ powders showed a tetragonal phase with (110) dominant orientation. The particle size of the $SnO_2$:Ni powders after ball-mill of 120 h was about 0.05 ${\mu}m$. The gas sensitivity (S = Rg/Ra) to 5 ppm $CH_4$ gas and $CH_3CH_2CH_3$ gas was measured at room temperature by comparing the resistance in air (Ra) with that of the target gases (Rg). The sensitivity of the $SnO_2$ gas sensors was enhanced by increasing the ball-mill time. There was an association between the sensitivity of both the $CH_4$ gas and the $CH_3CH_2CH_3$ gas and the particle size of the $SnO_2$. $SnO_2$ gas sensors prepared by 72 h ball-mill showed a sensitivity of about 13 to 5 ppm $CH_4$ gas and $CH_3CH_2CH_3$ gas. The response time of the $SnO_2$:Ni gas sensors to the $CH_4$ gas was about 20 seconds.

• 한국재료학회지
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• 제21권10호
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• pp.546-549
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• 2011

Nano-sized $SnO_2$ thick films were prepared by a screen-printing method onto $Al_2O_3$ substrates. The sensing characteristics were investigated by measuring the electrical resistance of each sensor in a test box as a function of the detection gas. The nano-sized $SnO_2$ thick film sensors were treated in a $N_2$ atmosphere. The structural properties of the nano $SnO_2$with a rutile structure according to XRD showed a (110) dominant $SnO_2$ peak. The particle size of $SnO_2$:Ni nano powders at Ni 8 wt% was about 45 nm, and the $SnO_2$ particles were found to contain many pores according to the SEM analysis. The sensitivity of the nano $SnO_2$-based sensors was measured for 5 ppm $CH_4$ gas and $CH_3CH_2CH_3$ gas at room temperature by comparing the resistance in air with that in the target gases. The results showed that the best sensitivity of $SnO_2$:Ni and $SnO_2$:Co sensors for $CH_4$ gas and $CH_3CH_2CH_3$ gas at room temperature was observed in $SnO_2$:Ni sensors doped with 8 wt% Ni. The response time of the $SnO_2$:Ni gas sensors was 10 seconds and recovery time was 15 seconds for the $CH_4$ and $CH_3CH_2CH_3$ gases.

• 대한화학회지
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• 제24권4호
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• pp.288-294
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• 1980

$CH_3O(CO)Cl,\;CH_3S(CO)Cl\;및\;CH_3S(CS)Cl$/TEX>의 가메탄올 분해반응속도를 메탄올-아세토니트릴 혼합용매하에서 결정하였다. 반응속도는 주로 벌크한 용매성질에 의해서만 아니라 일부 친전자적 특수용매화에 의해서도 영향을 받는다는 것이 실험결과로 알려졌다. 용매의 극성은 반응속도에 영향을 미치는 중요인자는 아니지만, $S_N1$형의 천이상태 안정화에 기여함을 알았다. $CH_3S(CS)Cl$/TEX>의 가메탄올 분해반응은 메탄올에 의한 이탈기의 특수 용매효과 및 큰 유전상수를 가진 용매에 의한 천이상태 안정화가 중요한 $S_N1$형으로 진행됨을 알았다. $CH_3O(CO)Cl$의 가메탄올 분해반응은 위의 경우와는 반대로 $S_N2$형으로 진행됨을 알았다.

• 한국재료학회지
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• 제23권4호
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• pp.211-214
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• 2013

The effects of a Ni coating on the sensing properties of nano ZnO:Ni based gas sensors were studied for $CH_4$ and $CH_3CH_2CH_3$ gases. Nano ZnO sensing materials were prepared by the hydrothermal reaction method. The Ni coatings on the nano ZnO surface were deposited by the hydrolysis of zinc chloride with $NH_4OH$. The weight % of Ni coating on the ZnO surface ranged from 0 to 10 %. The nano ZnO:Ni gas sensors were fabricated by a screen printing method on alumina substrates. The structural and morphological properties of the nano ZnO : Ni sensing materials were investigated by XRD, EDS, and SEM. The XRD patterns showed that nano ZnO : Ni powders with a wurtzite structure were grown with (1 0 0), (0 0 2), and (1 0 1) dominant peaks. The particle size of nano ZnO powders was about 250 nm. The sensitivity of nano ZnO:Ni based sensors for 5 ppm $CH_4$ gas and $CH_3CH_2CH_3$ gas was measured at room temperature by comparing the resistance in air with that in target gases. The highest sensitivity of the ZnO:Ni sensor to $CH_4$ gas and $CH_3CH_2CH_3$ gas was observed at Ni 4 wt%. The response and recovery times of 4 wt% Ni coated ZnO:Ni gas sensors were 14 s and 15 s, respectively.

• 한국재료학회지
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• 제25권6호
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• pp.300-304
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• 2015

Nanorod ZnO and spherical nano ZnO for gas sensors were prepared by hydrothermal reaction method and hydrazine method, respectively. The nano-ZnO gas sensors were fabricated by a screen printing method on alumina substrates. The gas sensing properties were investigated for hydrocarbon gas. The effects of Co concentration on the structural and morphological properties of the nano ZnO:Co were investigated by X-ray diffraction and scanning electron microscope (SEM), respectively. XRD patterns revealed that nanorod and spherical ZnO:Co with a wurtzite structure were grown with (100), (002), (101) peaks. The sensitivity of nanorod and spherical ZnO:Co sensors was measured for 5 ppm $CH_4$ and $CH_3CH_2CH_3$ gas at room temperature by comparing the resistance in air with that in target gases. The highest sensitivity to the $CH_4$ and $CH_3CH_2CH_3$ gas of spherical nano ZnO:Co sensors was observed at Co 6 wt%. The spherical nano ZnO:Co sensor exhibited a higher sensitivity to hydrocarbon gas than nanorod ZnO.