• Title/Summary/Keyword: 전이금속 산화물

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Recent Developments and Challenging issues of Solid Catalysts for Biodiesel Production (바이오디젤 생산용 고체 촉매의 개발 동향 및 과제)

  • Lee, Jin-Suk;Park, Soon-Chul
    • Korean Chemical Engineering Research
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    • v.48 no.1
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    • pp.10-15
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    • 2010
  • Intensive works have been carried out to develop more efficient solid catalysts for biodiesel production from various feedstocks including refined oils and waste fats. Among many catalysts, metal oxides and ion exchange resins are the most intensively studied ones. With regard to metal oxide catalysts, major research activities have focused on the identification of the active compounds and their immobilizing methods on the supports. As metal oxide catalysts have strong thermal stability, they may be used in simultaneous transesterification and esterification of waste fats. However, ion exchange resin catalysts were mainly applied in the esterification of the free fatty acids in waste fats because of their lower thermal stability. For both solid catalysts, further works are needed to make them to be used in commercial process. Especially fast deactivation of the solid catalyst would be the most challenging problem.

Alcohol Detecting Characteristics of Catalytic Sensor (접촉연소식 센서의 알코올 검지 특성)

  • Kim, Jong-Won;Son, Young-Mok;Sim, Kyu-Sung;Park, Kee-Bae;Lee, Sang-Ho
    • Journal of Sensor Science and Technology
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    • v.3 no.1
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    • pp.32-39
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    • 1994
  • Catalytic combustion type sensor was fabricated for alcohol detection, and its characteristics were tested. When the resistance of Pt coil for pellistor is 2.0 ohm, suggestible input power to bridge circuit was about 300 mW for methanol detection, and in the range from 350 mW to 400 mW for ethanol. Pellistors were prepared by means of impregnating Pt or Pd on the ${\gamma}$-alumina bead for sensing element, and transition metals such as $Co_{3}O_{4}$, $Fe_{2}O_{3}$ for compensating element.

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The Simulation of MAS-NMR Spectrum by the Voight Lineshape (Voight 함수를 이용한 MAS-NMR 스펙트럼 시뮬레이션)

  • Kang, Myoung Jin;Shim, Moon Sik;Ryu, Yung Rae
    • Journal of Korean Ophthalmic Optics Society
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    • v.2 no.1
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    • pp.17-24
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    • 1997
  • The Voight function which results from the convolution of the Gauss and Lorentz function is applied the MAS-NMR simulation of mixed alkali glasses and the glasses doped transition metal oxides. It is well known that the convolution of the Gauss and Lorentz function cannot be integrated in closed form for arbitrary values. So we make the new computer simulation program from which the Voight lineshape is obtained. The results are accorded well with the MAS-NMR spectra and we can find out the very small change of MAS-NMR lineshape.

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Effect of heat treatment on the electrical and optical properties of ZnO : Al thin films prepared by reactive magnetron sputtering method (반응성 sputtering법으로 제막된 ZnO : Al 박막의 전기.광학적 특성에 미치는 열처리의 영향)

  • 유세웅;유병석;이정훈
    • Journal of the Korean Crystal Growth and Crystal Technology
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    • v.6 no.4
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    • pp.493-500
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    • 1996
  • AZO transparent conducting thin films were fabricated by reactive DC magnetron sputtering method using Zn metla target containing 2 wt% of Al, and electrical and optical properties were investigated after heattreatment. Electrical resistivity was reduced 50% and had reached $1{\times}10^{-3}~3.5{\times}10^{-4}\;{\Omega}cm$ by heat treatment. In the case of oxide AZO films, the resistivity of $10^{3}\;{\Omega}cm$ was also decreased to $2{\times}10^{-3}\;{\Omega}cm$ after heat treatment. The optical transmittance of AZO films deposited in the transition range was increased from 59.4 % to 77.4 % by $400^{\circ}C$, 30 min heat treatment.

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Properties of charge/discharge in synthesis method or substituting transition element for Li-Mn Oxide (전이금속 치환 및 합성방법에 따른 Li-Mn 산화물의 충방전 특성)

  • Jee, Mi-Jung;Choi, Byung-Hyun;Lee, Dae-Jin
    • Proceedings of the Korean Institute of Electrical and Electronic Material Engineers Conference
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    • 2007.06a
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    • pp.46-46
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    • 2007
  • There has been rapid progress in the portable electronics industry. which has led to a great increase for a demand of portable, lightweight power sources. Lithium 2'nd batteries have met these demand. and many studies on the cahtod materials for the lithium 2,nd batteries have been reported during the last decade. Possible candidates for the cathode materials for lithium 2,nd batteries are $LiCoO_2$, $LiNiO_2$, and $LiMn_2O_4$. Currently $LiCoO_2$ is widely used. but $LiMn_2O_4$ is an excellent alternative material in view of its several advantages such a low cost as well as the wasy availability of raw materials and environmental benignity. In this study, find the most suitable synthesis method that satisfied high capacitor and stability cycle character, etc in Li-Mn oxide for 2'nd batteries. And also made an experiment on doping the $LiMn_2O_4$ spinel with a small amount of metal ions has a remarkable effect on the electrochemical properties and characterics of powder, BET, PSA, Porosity, etc.

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Synthesis of Non-Noble Metal Catalysts for Oxygen Evolution Reaction by Co-Precipitation (공침법을 이용한 비 귀금속 산소 발생 반응 촉매의 합성)

  • Jang, Myeong-Je;Won, Mi-So;Lee, Gyu-Hwan;Choe, Seung-Mok
    • Proceedings of the Korean Institute of Surface Engineering Conference
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    • 2017.05a
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    • pp.68.1-68.1
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    • 2017
  • 수소에너지의 무한한 가능성이 주목됨에 따라 과전압이 높은 산소 발생 촉매의 효율 향상 및 제작비용의 절감은 중요한 문제가 되어왔다. 백금계 촉매는 높은 효율과 낮은 과전압을 가지고 있지만 적은 매장량과 비싼 가격으로 수전해의 상용화에 큰 장애물이 되어왔다. 전이 금속 산화물 촉매는 가격이 저렴하고 형상과 크기 등에 따라 백금계 촉매에 비등한 성능을 발휘할 수 있다. 본 발표에서는 산소발생을 위한 촉매로서 Cu와 Co를 co-precipitation법을 이용하여 $Cu_xCo_{(3-x)}O_4$를 제작하고 이를 셀, 스택에 적용한 방법을 소개한다. 본문에서는 용액의 pH를 다르게 합성하여 Cu와 Co의 비율을 변화시켜 형상, 결정성을 조절할 수 있었고, 이러한 다른 조건에서 산소 발생 성능의 변화를 측정하였다. 최종적으로 최적의 성능을 나타내는 산소 발생 촉매를 셀 및 스택에 적용하여 실제적인 성능을 측정하였다.

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Electronic Structure and Surface Phonon of Ultrathin MgO Layers on TiC(001) Surface (TiC(001) 면에 성장된 MgO 초박막의 전자구조 및 표면포논)

  • Hwang, Yeon;Souda, Ryutaro
    • Korean Journal of Materials Research
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    • v.7 no.8
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    • pp.694-700
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    • 1997
  • TiC(001) 면위에 Mg 금속을 단원자층으로 증착시킨 후 산화 및 열처리 과정을 거쳐서 MgO 초박막을 성장시키고, 성장된 MgO 막의 전자상태 및 표면포논을 UPS, XPS 및 HREELS를 사용하여 측정하였다. 전도성 기판위에 epitaxial 산화물막을 성장시킨 후 성장된 막의 전자구조 및 표면포논을 측정함으로써 벌크에서 분리된 2차원적 특성을 갖는 '표면 모델'의 물성을 연구하고자 하였는데, 이러한 '표면모델'은 잘 배열된 원자구조를 얻을 수 있고 두께가 충분히 얇아서 전하축적을 피할 수 있기 때문이다. 기판으로는 MgO와 같은 암염형 결정구조를 갖고 있고, 격자상수 차이가 2.6% 로서 매우 작으며, 비저항이 매우 낮은 전이 금속 탄화물 중의 하나인 TiC(001) 면을 사용하였다. TiC(001)면에 증착된 MgO층의 UPS He-l 스펙트럼을 측정한 결과 O2p및 XPS스펙트럼은 열처리를 전후로 하여 변하지 않았으며, 이로부터 상온에서 산소의 확산만으로 MgO 상이 형성됨을 알 수 있었다. MgO초박막의 표면 포논을 HREELS를 사용하여 검출하였다. 거시적 포논중에서 F-K 파 및 Rayleigh 모드가 관찰되었는데, F-k파는 MgO막의 2차원성으로 인하여 벌크의 경우보다 높은 진동 에너지를 갖고 있었고 Rayleigh모드는 벌크 MgO와 유사한 분산관계를 보였다. 미시적 포논중에서 Wallis(S/sub 2/)모드가 측정되었는데, 그 진동에너지는 벌크에서와 같고 off-specular방향에서도 소멸되지 않았다.

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Variation of Band Gap Energy upon Structural Distortion for Nb-containing Oxyfluorides (Nb를 포함하는 불소산화물에서 구조적 뒤틀림에 따른 에너지 띠 간격의 변화)

  • Kim, Hyun-Jun;Kim, Seung-Joo
    • Journal of the Korean Chemical Society
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    • v.51 no.3
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    • pp.265-269
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    • 2007
  • A comparative study on crystal structures and UV-visible diffuse reflectance spectra for Nb-containing oxyfluorides was performed to probe the relationship between energy band gap and local structure. The oxyfluorides, RbSrNb2O6F, RbCaNb2O6F and RbNb2O5F are commonly composed of the corner-sharing NbO5F octahedra as structural building units. The average Nb-O(F)-Nb bond angles, which can be a measure of the structural distortion, are 158.6° for RbSrNb2O6F, 149.6° for RbCaNb2O6F and 139.5° for RbNb2O5F. As the bond angle decreases, the band gap increases: 3.48eV for RbSrNb2O6F, 3.75eV for RbCaNb2O6F and 4.03 eV for RbNb2O5F. This experimental result implies that the band gap can be controlled with a range of 0.6 eV through a variation of local structure for the Nb-containing oxyfluorides.

Catalytic Oxidation of Vinyl Chloride on Chromium Oxide Catalysts (크롬 산화물 촉매를 이용한 Vinyl Chloride의 산화 분해반응)

  • Lee, Hae-Wan;Kim, Young Chai;Moon, Sei-Ki
    • Applied Chemistry for Engineering
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    • v.10 no.1
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    • pp.58-66
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    • 1999
  • The catalytic oxidation of vinyl chloride was investigated over $CrO_x$ impregnated on $Al_2O_3$ at temperature between 200 and $400^{\circ}C$. The major carbonaceous products were CO and $CO_2$, and the selectivity of $CO_2$ was gradually increased with increasing reaction temperature, while that of CO was dropped consequently. This suggests that CO is the first product which is further oxidized to $CO_2$ in the oxidation of vinyl chloride over $CrO_x/Al_2O_3$. The addition of HCl in the feed didn't affect the conversion of vinyl chloride, but the selectivity of $CO_2$ decreased by adding HCl. It implies that HCl inhibits, the complete oxidation of vinyl chloride to $CO_2$. When oxidizing vinyl chloride in dry air, significant amounts of $Cl_2$ were observed, while no $Cl_2$ was detected in the humid condition. The activities of several catalysts including various precious metals and other transition metal oxides were measured, it was found that the catalytic activity of 12% $CrO_x/Al_2O_3$ was higher than other catalysts except 1% $Pt/Al_2O_3$. The reaction rate of 12% $CrO_x/Al_2O_3$ was 1.2 times lower than that of 1% Pt/alumina, but it was 3 to 8 times more active than other catalysts for vinyl chloride oxidation at $275^{\circ}C$.

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DFT Calculations for the Hydrogen Transfer Reaction in Bis(μ-oxo)dicopper-enzyme (DFT방법을 이용한 Bis(μ-oxo)dicopper-enzyme의 수소이동반응 연구)

  • Park, Ki-soo;Kim, Yong-Ho
    • Journal of the Korean Chemical Society
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    • v.53 no.5
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    • pp.499-504
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    • 2009
  • Metals have often played important roles to some enzymatic reactions that are essential to biological processes. Therefore many scientists have studied the reaction mechanisms of catalytic reactions in metaloenzymes for many years. Methane MonoOxygenase (MMO) is an enzyme that oxidize methane to methyl alcohol. Recently Tolman et al. studied a model reaction for MMO, which is a hydroxide transfer reaction in Bis-($\mu$-oxo)-dicopper complex, and suggested several possible mechanisms. Later a two-step mechanism, which is hydrogen transfer followed by hydroxide rebound, was proposed from theoretical studies. In this study we calculated the reactant, product, and the transition state structures, and energetics of the first hydrogen transfer reaction using various DFT methods including recently developed the MO6 family of DFT, namely, MO6, MO6L, and MO6-2X. We found that the M06/6-31G(d,p)/LANL2DZ method reproduce the experimental XRD structure of reactants very well. The TS structures, barrier heights, and reaction energies depend very much on the size of the basis sets.