• Title/Summary/Keyword: Li:ZnO

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Binding energy of H2 to MOF-5: A Model Study

  • Lee, Jae-Shin
    • Bulletin of the Korean Chemical Society
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    • v.32 no.12
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    • pp.4199-4204
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    • 2011
  • Using models simulating the environment of two distinct adsorption sites of $H_2$ in metal-organic framework-5 (MOF-5), binding energies of $H_2$ to MOF-5 were evaluated at the MP2 and CCSD(T) level. For organic linker section modeled as dilithium 1,4-benzenedicarboxylate ($C_6H_4(COO)_2Li_2$), the MP2 and CCSD(T) basis set limit binding energies are estimated to be 5.1 and 4.4 kJ/mol, respectively. For metal oxide cluster section modeled as $Zn_4O(CO_2H)_6$, while the MP2 basis set limit binding energy estimate amounts to 5.4 kJ/mol, CCSD(T) correction to the MP2 results is shown to be insignificant with basis sets of small size. Substitution of benzene ring with pyrazine ring in the model for the organic linker section in MOF-5 is shown to decrease the $H_2$ binding energy noticeably at both the MP2 and CCSD(T) level, in contrast to the previous study based on DFT calculation results which manifested substantial increase of $H_2$ binding energies upon substitution of benzene ring with pyrazine ring in the similar model.

A Study on the Properties of the Low Temperature Sintered Piezoelectrics for Actuator Application (압전 액츄에이터에 활용할 저온소결 압전 세라믹스에 관한 연구)

  • Ryu, Sung-Lim;Lee, Sang-Ho;Yoo, Ju-Hyun
    • Journal of the Korean Institute of Electrical and Electronic Material Engineers
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    • v.21 no.3
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    • pp.232-235
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    • 2008
  • In this study, in order to develop the composition ceramics for multilayer piezoelectric actuator, PMN-PNN-PZT ceramics were fabricated using $Li_2CO_3$, $Na_2CO_3$, ZnO as sintering aids and their piezoelectric and dielectric properties were investigated according to the Bi substitution, Bi substitution induced grain growth and increase of sinterablity, And also, Bi substitution suppress secondary phase due to the liquid phase sintering effect. Bi substitution enhanced electromechanical coupling factor ($k_p$) and dielectric constant ($\varepsilon_r$), However, mechanical quality factor($Q_m$) was deteriorated, At the sintering temperature of 870 $^{\circ}C$ and Bi substitution of 1 mol%, density, electromechanical coupling factor ($k_p$), mechanical quality factor ($Q_m$), Dielectric constant ($\varepsilon_r$) and piezoelectric constant ($d_{33}$) of specimen showed the optimum values of 7,878 $g/cm^3$, 0,608, 835, 1603 and 397 pC/N, respectively for multilayer piezoelectric actuator application.

A Study on the Low Temperature Sintering Piezoelectric Ceramics for Piezoelectric Actuator Application (압전 액츄에이터에 활용할 저온소결 압전 세라믹스에 관한 연구)

  • Ryu, Sung-Lim;Lee, Yu-Hyung;Lee, Sang-Ho;Yoo, Ju-Hyun
    • Proceedings of the Korean Institute of Electrical and Electronic Material Engineers Conference
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    • 2007.11a
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    • pp.277-278
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    • 2007
  • In this study, in order to develop multilayer piezo-actuator, PMN-PNN-PZT ceramics were fabricated using $Li_2CO_3,\;Na_2CO_3$, ZnO as sintering aids and their piezoelectric and dielectric properties were investigated according to the Bi substitution. Bi substitution enhanced electromechanical coupling factor$(k_p)$ and dielectric constant$({\varepsilon}_r)$. However, mechanical quality factor was deteriorated. At the sintering temperature of $870^{\circ}C$ and Bi substitution of 1mol%, density, electromechanical coupling factor$(k_p)$, mechanical quality factor$(Q_m)$, Dielectric constant$({\varepsilon}_r)$ and piezoelectric constant$(d_{33})$ of specimen showed the optimum value of $7.878g/cm^3$, 0.608, 835, 1603 and 397pC/N, respectively.

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Potential Element Retention by Weathered Pulverised Fuel Ash : II. Column Leaching Experiments (풍화 석탄연소 고형폐기물(Pulverised Fuel Ash)의 중금속 제거가능성 : II. 주상용출실험)

  • Lee, Sanghoon
    • Economic and Environmental Geology
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    • v.28 no.3
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    • pp.259-269
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    • 1995
  • Column leaching tests were conducted using fresh and weathered pulverised fuel ash of some 17 and 40 years old from two major British power plants, with deionised water and simulated synthetic industrial leachate. The former was to see the leaching behaviour of weathered ash and the latter was to see if the formation of secondary products from water and PFA interaction and ameliorating effect in removing metals from industrial leachates. Fresh PFA liberates elevated concentrations of surface-enriched inorganics, including Ca, Na, K, B, $Cr_{total}$, Li Mo, Se and $SO^{2-}_4$. This might indicate their association with the surface of PFA particles. In the column leaching tests using weathered ash and deionised water, elements are not readily leached but are released more slowly, showing relatively constant concentrations. For the case of weathered ash, some readily soluble surface-enriched elements appears to have been liberated in their early stage of leaching and the liberation of glass associated elements are thought to be more important function in controlling the element concentration. The result from column leaching tests exceed for a number of elements when compared with various Water Standards and suggests the leachate from PFA disposal mound needs dilution to achieve target concentrations. PF A shows element retention effect for many elements, including B, Fe, Zn, Hg, Ni, Li and Mo, in the order of fresh Drax ash > weathered Drax ash > Weathered Meaford ash in retaining capacity. Geochemical modelling using a computer program WATEQ4F reveals some solubility controlling secondary solid products. These include $CaSO_4{\cdot}2H_2O$ for Ca, $Al(OH)_3$ for Al and $Fe(OH)_3$ for Fe.

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Determination of Metal Levels in Shamma (Smokeless Tobacco) with Inductively Coupled Plasma Mass Spectrometry (ICP-MS) in Najran, Saudi Arabia

  • Brima, Eid I.
    • Asian Pacific Journal of Cancer Prevention
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    • v.17 no.10
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    • pp.4761-4767
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    • 2016
  • Objective: The use of Shamma (smokeless tobacco) by certain groups is giving rise to health problems, including cancer, in parts of Saudi Arabia. Our objective was to determine metals levels in Shamma using inductively coupled plasma mass spectrometry (ICP-MS). Methods: Thirty-three samples of Shamma (smokeless tobacco) were collected, comprising four types: brown Shamma (n = 14.0), red Shamma (n = 9.0), white Shamma (n = 4.0), and yellow Shamma (n = 6.0). All samples were collected randomly from Shamma users in the city of Najran. Levels of 11 elements (Al, As, Cd, Co, Cr, Cu, Li, Mn, Ni, Pb, and Zn) were determined by ICP-MS. Results: A mixed standard (20 ppb) of all elements was used for quality control, and average recoveries ranged from 74.7% to 112.2%. The highest average concentrations were found in the following order: Al ($598.8-812.2{\mu}g/g$), Mn ($51.0-80.6{\mu}g/g$), and Ni ($23.2-53.3{\mu}g/g$) in all four Shamma types. The lowest concentrations were for As ($0.7-1.0{\mu}g/g$) and Cd ($0.0-0.06{\mu}g/g$). Conclusions: The colour of each Shamma type reflects additives mixed into the tobacco. Cr and Cu were showed significant differences (P < 0.05) among Shamma types. Moreover, Pb levels are higher in red and yellow Shamma, which could be due to use (PbCrO4) as yellow colouring agent and lead tetroxide, Pb3O4 as a red colouring agent. The findings from this study can be used to raise public awareness about the safety and health effects of Shamma, which is clearly a source of oral exposure to metals.

박막 실리콘 태양전지의 도핑층 광손실 제거 기술

  • Baek, Seung-Jae;Pang, Ryang;Park, Sang-Il;Im, Goeng-Su
    • Proceedings of the Korean Vacuum Society Conference
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    • 2012.08a
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    • pp.194-195
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    • 2012
  • 박막 실리콘 태양전지에 입사한 빛 중 흡수층인 진성 비정질 실리콘층(i-a-Si)에 흡수된 빛은 출력으로 변환되나, 기타의 층에서 흡수된 빛은 손실 성분이 된다. 이 중 흡수 손실이 큰 층은 도핑 층(p-a-SiC 및 n-a-Si)들인데, 이 들의 흡수 손실을 측정된 광학함수를 이용해 계산해 보면 Fig. 1과 같이 나타난다. p-a-SiC은 광 입사부에 위치하여 단파장 영역의 흡수 손실을 일으키고, n-a-Si 은 태양전지의 후면에 위치하여 장파장 영역의 흡수손실을 일으킨다. 이러한 도핑층에서의 흡수 손실을 제거 또는 개선하기 위해 도핑층의 재료를 기존 재료보다 광학적 밴드갭이 큰 재료로 대체하여 개선하는 방안에 대해 논하고자 한다. 금속 산화물의 밴드갭은 실리콘 화합물에 비하여 대체로 큰 값을 가지기 때문에 이를 기존의 실리콘 화합물 대신으로 사용한다면 광학적 흡수 손실을 효과적으로 줄일 수 있다. 단, 이때 태양전지의 광 전압을 결정하는 인자가 p층과 n층 사이의 일함수 차이에 해당하므로, p층의 대체층으로 사용 가능한 금속 산화물은 일함수가 큰(>5 eV) 재료 중에서 선택하는 것이 적합하며, n층의 대체층으로 사용 가능한 금속 산화물은 일함수가 작은(< 4.2 eV) 재료 중에서 선택하는 것이 적합하다. Table 1에서 p층과 n층 대체용 금속산화물의 후보들을 정리하였다. 먼저 도핑층에서의 광 흡수가 광손실이 될 수 밖에 없는 물리적 근거에 대해서 논하고, 그 실험적인 증명을 제시한다. 이러한 개념을 바탕으로 도핑층의 내부 전기장의 방향을 제어하여 전자-정공쌍을 분리 수집하는 방법을 실험적으로 구현하였다. 이어서 금속 산화물을 부분적으로 대체하여 흡수 손실을 개선하는 방안을 제시한다. WOx, NiOx, N doped ZnO 등을 적용하여 그 효과를 비교 검토하였다. 끝으로 금속산화믈 대체 또는 쇼트키 접합을 적용하여 도핑층의 광 흡수를 줄이고 효율을 향상하는 방안을 제시한다. 그 사례로서 WOx, MoOx, LiF/Al의 적용결과를 살펴보고 추가 개선방안에 대해 토의할 것이다. 결론적으로 광학적 밴드갭이 큰 재료를 도핑층 대신 사용하여 흡수 손실을 줄이는 것이 가능하다는 것을 알 수 있고, 이 때 일함수 조건이 만족이 되면 광 전압의 손실도 최소화할 수 있다는 점을 확인할 수 있었다. 현재까지 연구의 한계와 문제점을 정리하고, 추가 연구에 의한 개선 가능성 및 실용화 개발과의 연관관계 등을 제시할 것이다.

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$\alpha$-D-Glucosidase Inhibitor from Streptomyces sp. (II) -Cultural Conditions for the Inhibitor Production- (Streptomyces 속 균주가 생성하는 $\alpha$-D-Glucosidase Inhibitor(II)-저해물질의 생산조건 -)

  • 도재호;주현규
    • Microbiology and Biotechnology Letters
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    • v.17 no.3
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    • pp.207-212
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    • 1989
  • Cultural conditions for $\alpha$-D-Glucosidase Inhibitor production from Streptomyces sp. YS-221-B isolated from soil arid identified as Streptomyces flauovirens or a subspecies of it were investigated. When the strain was cultured in a flask containing 2% glucose, 0.3% asparagine, 0.0002% riboflavin, 0.05% $K_2$HPO$_4$, 0.1% MgSO$_4$.7$H_2O$, 0.05% NaCl, pH 8.0 at 3$0^{\circ}C$, maximum production of the inhibitor was obtained after 8-9 days of cultivation. Sugar alcohols such as mannitol, i-inositol, erythritol as carbon sources, asparagine and beef extract as nitrogen sources were favorable for inhibitor production. Among vitamins, riboflavin, p-aminobenzoic acid, pyridoxamine and folic acid promoted the production of inhibitor, but depressed by the addition of hesperidine, and also depressed by cobalt, lithium and ferrous salts.

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Effect of Drying Methods on the Quality in Lycii Fructus (구기자(枸杞子)의 건조방법(乾燥方法)이 품질(品質)에 미치는 영향(影響))

  • Cho, Im-Shik;No, Jae-Goan;Park, Jong-Sang;Li, Run-Huai
    • Korean Journal of Medicinal Crop Science
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    • v.4 no.4
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    • pp.283-287
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    • 1996
  • As a part of studies on the quality control for drying methods in Lycii Fructus. Dried Lycii Fructus were obtained from several treatments to examine the control of the extracts and its physical properties, and also to analyze the inorganic elements and proximate compositions. The results were summerized as follows; the changes of solid matter contents dried at $50^{\circ}C\;for\;4\;hrs\;and\;60^{\circ}C$ for 28 hrs were highest. The changes of Hunter values were 66 in lightness, 5.0 in redness and 51.3 in yellowness, respectively in treatment No. 1. And also the viscosity of treatment No. 1. was some high compared to the other treatment. The desirable drying temperature were at $50^{\circ}C$ for 2hrs in initial and at $60^{\circ}C$ for 24hrs in final temperature and it was the best conditions as a quality, economics and chemical compositions of Lycii Fructus.

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Geochemical Characteristics and Trace Metal Speciation of Soils in Major Source Area of Asian Dust (주요 황사발원지 토양의 지구화학적 특성 및 미량원소 존재형태 연구)

  • Lee, Pyeong-Koo;Youm, Seung-Jun;An, Gi-O
    • Economic and Environmental Geology
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    • v.45 no.1
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    • pp.9-21
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    • 2012
  • In this study, we investigated the chemical characteristics of soils collected from the several deserts and loess in China known as the typical source areas of Asian dust (the Taklamakan desert, the Alashan desert, the Ordos desert and the Loess Plateau). Based on our analysis, we examined the possibility of adverse effects on environments and human health. In each desert and loess, major elemental compositions of soils did not show large variations, implying that the long-periodic mixing of soils in each area made their chemical compositions homogeneous. Minor elements of soils in each desert and loess showed more complicated patterns with strong correlations each other (e.g., Cr, Cu, As, Co, Ni, V, Y, Sc, Sn, Pb, Zn, Cd, Cs, Li, Th, U). These results thus enable us to discriminate the soil of the Loess Plateau from those of the other deserts in China. The results of sequential extraction experiments for soils showed that the chemical speciation of Fe was dominant in residual fraction (>85%) in all deserts and loess, but the fractions of Mn and Ca chemical speciations were very different in each area. In the case of Mn, the fraction of amorphous Fe-Mn hydroxides (55.4%) in the Central Loess Plateau and the carbonate fraction (33.8%) in Taklamakan desert were higher as much as 2 to 5 times than other deserts. The chemical speciations of Ca are dominant in carbonate fraction in Taklamakan (75.9%) and Alashan (50.5%) deserts, but carbonate fractions of Ca in the Loess Plateau and Ordos deserts were low (6.6% and 2.1%, respectively). According to the mobility of trace elements inferred from the results of sequential extraction procedure, we could classify them into five groups, and the mobility of Cd, Pb and Cu are more than 87%, 33% and 30%, respectively. Therefore, Cd, Pb and Cu in soils of deserts and loess could be easily dissolved when interacted with surface water. As such, they could give adverse effects on surficial environments and human health.

Characterization of Chitin Deacetylase Produced from Mucor rouxii (Mucor rouxii가 생산한 Chitin deacetylase의 특성)

  • SOHN Heung-Sik;PARK Seong-Min;SON Byung-Yil;CHOI Hyeon-Mee;LEE Keun-Tai
    • Korean Journal of Fisheries and Aquatic Sciences
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    • v.32 no.2
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    • pp.121-126
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    • 1999
  • In order to degrade chitin by enzymatic hydrolysis, it is required from screening highly active deacetylase. To this end, we examined three fungal strains and it turned out that Mucor rouxii produced highly active deacetylase, this enzyme exhibited the highest enzymatic activity against colloidal chitin. The conditions for growing Mucor rouxii are as follows; the effective carbon source, nitrogen source, adequate initial pH, temperature and incubation time were $2\%$ glucose, $1.33\%$ yeast extract, $0.66\%$ pepton, 4.5, $25{\pm}2^{\circ}C$ and 48hr, respectively. The optimum pH and temperature for purified enzyme activity were 5.5 and $40^{\circ}C$, respectively. The purified enzyme was stable at pH ranging from 4.5 to 5.5. However, the enzyme activity was decreased to less than $50\%$ at pH blow 45 and above 7.5. At temperatures above $50^{\circ}C$, the enzyme activity was decreased remarkably. The enzyme was inhibited by LiC1, $HgCl_2$, and $BaCl_2$, but stimulated by $CaCl_2$ and $ZnC1_2$, The activity of purified enzyme was increased by L-cysteine and 2-mercaptoethanol, while decreased by O-phenanthroline, p-CMB, EDTA, and iodoacetate. The $K_m$ and the $V_{max}$ value of purified enzyme were $1.2\%$ and 59.5 U/mg, respectively. The deacetylation activity of purified enzyme was not detected at optimal reaction condition when chitin particle suspension was used.

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