• Title/Summary/Keyword: $H_2O $

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Ab initio Calculations of Protonated Ethylenediamine-(water)3 Complex: Roles of Intramolecular Hydrogen Bonding and Hydrogen Bond Cooperativity

  • Bu, Du Wan
    • Bulletin of the Korean Chemical Society
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    • v.22 no.7
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    • pp.693-698
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    • 2001
  • Ab initio density functional calculations on the structural isomers, the hydration energies, and the hydrogen bond many-body interactions for gauche-, trans-protonated ethylenediamine-(water)3 complexes (g-enH+(H2O)3, t-enH+(H2O)3) have been performed. The structures and relative stabilities of three representative isomers (cyclic, tripod, open) between g-enH+(H2O)3 and t-enH+(H2O)3 are predicted to be quite different due to the strong interference between intramolecular hydrogen bonding and water hydrogen bond networks in g-enH+(H2O)3. Many-body analyses revealed that the combined repulsive relaxation energy and repulsive nonadditive interactions for the mono-cyclic tripod isomer, not the hydrogen bond cooperativity, are mainly responsible for the greater stability of the bi-cyclic isomer.

Effects of $O_2$ saturation and pH on Gas-bubble disease of blue crab, Portunus trituberculatus (꽃게, Portunus trituberculatus 유생의 가스병 발생에 미치는 산소포화도 및 pH의 영향)

  • Kang, Ju-Chan;Rho, Sum
    • Journal of fish pathology
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    • v.8 no.2
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    • pp.157-164
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    • 1995
  • In order to examine the effects of $O_2$ saturation and pH on gas-bubble disease of blue crab, portunus trituberculatus, zoeal larvae were reared under 5 different concentrations (6.0, 4.0, 3.1, 2.2, and 0.7million cell/cc) of Chlamydomones sp. under natural light for 4days. Observed pH and $O_2$ saturation in the rearing chamber increased drastically from 12 to 18 o'clock with the increasing of Chlamydomones sp. concentrations, but rapidly decreased from 2 to 6 o'clock in the rearing chamber. Gas-bubble disease of zoeal larvae was observed 4hours after starting of experiment at the pH 8.5 and 118% $O_2$ saturated conditions in rearing chamber during the day, and recovered rapidly with the decreasing of pH and $O_2$ saturation at night. Thus, gas-bubble disease of zoeal larvae was repeated with the increased pH($\geq$8.5) and $O_2$ saturation ($\geq$118%) almost every days. Mortality of zoeal larvae was observed when pH and $O_2$ saturations were reached 8.5 and 118% levels respectively, and deteriorated with the increasing of water temperature, pH and $O_2$ saturation.

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Extraction Behaviour of Np with DEHPA from the Low Nitric Acid Solution Containing Hydrogen Peroxide (과산화수소가 함유된 저산도 질산용액에서 DEHPA 추출제에 의한 Np의 추출거동)

  • Lee, E.H.;Yang, H.B.;Kim, K.K.;Lim, J.K.;Yoo, J.H.
    • Applied Chemistry for Engineering
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    • v.7 no.4
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    • pp.707-714
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    • 1996
  • Extraction behaviour of Np with DEHPA(di-(2-ethyhexyl)Phosphoric acid) from the low nitric acid solution(below 1M $HNO_3$) containing $H_2O_2$ as a reducing agent was studied at a batch system in order to establish the conditions of extraction and stripping and to enhance the extraction rate. As results, it was confirmed that the Np was mainly the pentavalent oxidation state in the low nitric acid solution. The extraction yield of Np was increased with increasing the concentration of DEHPA and $H_2O_2$ and decreased more rapidly with the increase of $HNO_3$ concentration. It was also found that the Np could be extracted into DEHPA even without the addiction any redox agents, although the extraction yield is rather low as about 70%. The extraction rate was proportional to the 0.516 power of $H_2O_2$ concentration and inversely proportional to 0.483 power of $HNO_3$ concentration as follows. $d[Np(V)]/dt=-1.391{\times}10^{-2}[H_2O_2]^{0.516}[HNO_3]^{-0.483}[Np(V)]$ Regardless of the $H_2O_2$, the Np extracted in the organic phase was effectively stripped to the aqueous phase with $H_2C_2O_4$. The Np could be stripped more than 92 % with 0.5M $H_2C_2O_4$.

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Properties of the Powders of the System Al2O3-ZrO2-Y2O3 Prepared by Precipitation Method (침전법으로 제조한 Al2O3-ZrO2-Y2O3계 분말의 특성)

  • 김준태;홍기곤;이홍림
    • Journal of the Korean Ceramic Society
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    • v.25 no.2
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    • pp.117-124
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    • 1988
  • The properties of the powders of the system Al2O3-ZrO2-Y2O3 prepared by precipitation method were investigated. Al2(SO4)3$.$18H2O3, ZrOCl2$.$8H2O and YCl3$.$6H2O were used as starting materials. Amorphous aluminum hydrate prepared by precipitation method was completely transformed to alpha Al2O3 as a result of calcining at 1100$^{\circ}C$ for 1 hr and gamma, delta and theta phases appeared as transition phases. In ZrO2-Y2O3 system prepared by co-precipitation method, the crystallization temperature of ZrO2 was increase with Y2O3 contents. The coupled crystallization occured in coprecipitated Al2O3-ZrO2-Y2O3 system, therefore the formation temperature of alpha Al2O3 and ZrO2-Y2O3 system. In this ternary system, the powder morphology showed a particular shape which was composed of large Al2O3 grains having small spherical ZrO2 particles within large Al2O3 grain and relatively large ZrO2 particles along the grian boundaries.

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Effects of Samul-Tang Extract on Vascular Endothelial Cells from Hydrogen Peroxide-induced Injury (사물탕(四物湯)이 혈관내피세포(血管內皮細胞)에 미치는 영향(影響))

  • Nam, Chang-Kyu;Kim, Young-Kyun;Moon, Byung-Soon
    • The Journal of Internal Korean Medicine
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    • v.20 no.1
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    • pp.83-98
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    • 1999
  • This study is designed to investigate the effects of Samul-Tang extract on the response of lactic dehydrogenase(LDH) release, cellular activity, lipid peroxidation, DNA synthesis and the changes of total protein of bovine pulmonary artery endothelial cells(PAEC) from hydrogen peroxide$(H_2O_2)$-induced injury. The results are as follows : 1. Samul-Tang significantly decreased $H_2O_2$-induced release of LDH from injured bovine PAEC. 2. Samul-Tang significantly repressed $H_2O_2$-induced cellular activity from injured bovine PAEC. 3. Samul-Tang significantly repressed $H_2O_2$-induced lipid peroxidation from injured bovine PAEC. 4. Samul-Tang significantly stimulated DNA synthesis in bovine PAEC. 5. Samul-Tang significantly repressed $H_2O_2$-induced changes of total protein volume from injured bovine PAEC. Above results suggest that Samul-Tang can protect bovine PAEC from $H_2O_2$-induced injury. These results can be effectively applied to the prevention and cure of cardiovascular and cerebrovascular diseases.

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Synthesis, Spectroscopic, and Biological Studies of Chromium(III), Manganese(II), Iron(III), Cobalt(II), Nickel(II), Copper(II), Ruthenium(III), and Zirconyl(II) Complexes of N1,N2-Bis(3-((3-hydroxynaphthalen-2-yl)methylene-amino)propyl)phthalamide (N1,N2-bis(3-((3-hydroxynaphthalen-2-yl)methylene-amino)propyl)phthalamide의 크롬(III), 망간(II), 철(III), 코발트(II), 니켈(II), 구리(II), 루테늄(III) 및 산화 지르코늄(II) 착물에 대한 합성과 분광학 및 생물학적 연구)

  • Al-Hakimi, Ahmed N.;Shakdofa, Mohamad M.E.;El-Seidy, Ahemd M.A.;El-Tabl, Abdou S.
    • Journal of the Korean Chemical Society
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    • v.55 no.3
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    • pp.418-429
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    • 2011
  • Novel chromium(III), manganese(II), iron(III), cobalt(II), nickel(II), copper(II), ruthenium(III), and zirconyl(II) complexes of $N^1,N^2$-bis(3-((3-hydroxynaphthalen-2-yl)methylene-amino)propyl)phthalamide ($H_4L$, 1) have been synthesized and characterized by elemental, physical, and spectral analyses. The spectral data showed that the ligand behaves as either neutral tridentate ligand as in complexes 2-5 with the general formula $[H_4LMX_2(H_2O)]{\cdot}nH_2O$ (M=Cu(II), Ni(II), Co(II), X = Cl or $NO_3$), neutral hexadentate ligand as in complexes 10-12 with the general formula $[H_4LM_2Cl_6]{\cdot}nH_2O$ (M=Fe(III), Cr(III) or Ru(III)), or dibasic hexadentate ligand as in complexes 6-9 with the general formula $[H_2LM_2Cl_2(H_2O)_4]{\cdot}nH_2O$ (M = Cu(II), Ni(II), Co(II) or Mn(II), and 13 with general formula $[H_4L(ZrO)_2Cl_2]{\cdot}8H_2O$. Molar conductance in DMF solution indicated the non-ionic nature of the complexes. The ESR spectra of solid copper(II) complexes 2, 5, and 6 showed $g_{\parallel}$ >g> $g_e$, indicating distorted octahedral structure and the presence of the unpaired electron in the $N^1,N^2$ orbital with significant covalent bond character. For the dimeric copper(II) complex $[H_2LCu_2Cl_2(H_2O)_4]{\cdot}3H_2O$ (6), the distance between the two copper centers was calculated using field zero splitting parameter for the parallel component that was estimated from the ESR spectrum. The antibacterial and antifungal activities of the compounds showed that, some of metal complexes exhibited a greater inhibitory effect than standard drug as tetracycline (bacteria) and Amphotricene B (fungi).

Preparation of Spherical Monodispersed $ZrO_2$ Fine Powders by Metal Alkoxide Method (금속 알콕사이드법에 의한 구형의 단분산 $ZrO_2$ 미립자의 제조)

  • 김병익;민경소;최상흘
    • Journal of the Korean Ceramic Society
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    • v.27 no.8
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    • pp.1064-1070
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    • 1990
  • ZrO2 fine powders were prepared by hydrolysis, adding 0.1, 0.2, 0.3, 0.4, 0.5, 0.6mol/1H2O/ethanol to 0.1 mol/l Zr(OC3H7)4/ethanol. When hydrolized by adding 0.1mol/l Zr(OC3H7)4/ethanol to 0.1, 0.2mol/l H2O/ethanol., spherical monodispersed ZrO2 fine powders were obtained. And in this condition average sizes were about 0.5, 0.3${\mu}{\textrm}{m}$, respectively. The more H2O/ethanol concentration increased, the more the particle size decreased and the particles were agglomerated strongly. Prepared powders were amorphous and hydrates. The calcined powders with 43$0^{\circ}C$ and 100$0^{\circ}C$ were showed tetragonal and monoclinic phase, respectively.

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Effects of $Cu^{++}-Catalyzed$ Peroxidation on Collagen Gelation ($Cu^{++}-Catalyzed$ Peroxidation이 Collagen Gelation에 미치는 영향)

  • Chung, Myung-Hee;Kim, Myung-Suk;Lee, Chung-Soo
    • The Korean Journal of Pharmacology
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    • v.19 no.2
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    • pp.35-44
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    • 1983
  • reactive oxygen species에 의해 나타나는 reactivity에 있어서 metal ions이 관여함이 시사되고 있다. 이미 알려진 reactive oxygen species와 metal ions의 상호작용 이외에 특히 $Cu^{++}$$H_2O_2$가 강력한 peroxidative action을 나타낸다는 사실이 알려져 있으며 $Cu^{++}-H_2O_2$가 biological system 에서의 조직파괴에 관여할 가능성이 저자들에 의해서 효소 및 조직치 구조 단백질의 gradation 효과를 관찰함으로써 시사되었다. 본 연구는 $H_2O_2$ 혹은 $H_2O_2$를 생성하는 효소계(xanthine과 xanthine oxidase 및 glucose과 glucose oxidase)에 $Cu^{++}$을 첨가하여 $Cu^{++}-H_2O_2$에 의한 peroxidation의 효과를 collagen gelation을 통하여 확인코저 수행하였으며 다음과 같은 결과를 얻었다. 1) $Cu^{++}(20\;{\mu}M)$$H_2O_2$에 의하며 collagen gelation은 현저히 억제되었으며 이같은 억제효과는 양자의 농도에 비례하였다. 2) $Cu^{++}-H_2O_2$ reactivity를 확인하는 다른 방법으로 glucose oxidase system를 이용하였다. glucose oxidase$(2.5{\mu}g/ml)$ 와 glucose(0.5 mM)는 collagen gelation에 영향을 미치지 않았으나 이에 $Cu^{++}$이 존재하면 gelation이 억제되었다. 이때 억제정도는 $glucose(0.125{\sim}l.25\;mM)$$Cu^{++}$의 농도에 비례하였다. 3) 여러 reactive oxygen species 가운데 $Cu^{++}-H_2O_2$ reactivity를 xanthine oxidase system을 이용하여 확인하였다. (a) collagen gelation은 xanthine oxidase(30 munits/ml)와 xanthine$(0.25{\sim}2\;mM)$에 의하여 억제되었다. (b) 이때 나타나는 collagen gelation의 억제는 superoxide dismutase에 의하여 완전히 회복되었으나 catalase에 의해서는 더욱 촉진되었다. 그러나 catalase에 의한 억제효과의 촉진은 1,4-diazabicyclo(2,2,2)octane에 의하여 완전히 소실되었다. 따라서 이 xanthine oxidase system에서는 $O_2-,\;H_2O_2,\;^1O_2$이 관여함을 알 수 있었다. (c) 그러나 $Cu^{++}(10\;{\mu}M)$이 존재하였을 때 collagen gelation은 superoxie dismutase에 의해 더욱 억제되었고 catalase에 의해서는 완전히 회복되었다. xanthine oxidase계에서 얻어진 결과는 여러 reactive oxygen species가운데 $H_2O_2$$Cu^{++}$에 의하여 peroxidation효과를 나타냄을 알 수 있었다. 이상의 결과로 미루어 볼 때 reactive oxygen species와 metal ions과의 상호작용 가운데 $Cu^{++}-H_2O_2$는 강한 반응을 나타내는 특이한 구성요소이고 헌재 시사되고 있는 reactive oxygen species의 biological effects에 비추어 $Cu^{++}-catalyzed peroxidation$도 병적상태에서 생체에 유해한 작용을 나타내는 요소임을 시사하며 특히 염증시 조직파괴역할에 관하여 고찰하였다.

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Sulfurization of Rare-Earth Oxides Using $H_2S$ and $SC_2$

  • Sato, Nobuaki;Sato, Soichi
    • Proceedings of the Korean Radioactive Waste Society Conference
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    • 2004.02a
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    • pp.60-63
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    • 2004
  • Sulfurization of rare-earth oxides R203 (R=Nd, Eu) using sulfurizing reagents, such as $H_2S$ and $SC_2$was examined for the sulfide magnetic separation of spent fuel. $EU_2O_3$was found to react with H$_3$S gas forming the mixture of $EU_2O_2S$ and EuS at 500 oC, while EuS was formed by $SC_2$ at 800 oC. In the case of the mixture of $R_2O_3$and $UO_2$, EuS and $ND_3S_4$ were formed as well as $EU_2O_2S$ and $Nd_2O_2S$ at 500oC in $H_2S$, though $UO_2$ remained unreacted.

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광-펜톤 반응을 이용한 Rhodamine B의 색 제거

  • Park, Yeong-Sik;Kim, Dong-Seok
    • Proceedings of the Korean Environmental Sciences Society Conference
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    • 2006.11a
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    • pp.345-349
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    • 2006
  • 수용성 안료인 RhB를 대상으로 광-펜톤 공정의 최전 운전조건을 구하고, 광-펜톤 공정을 구성하는 개별 공정을 비교한 결과 다음의 결론을 얻었다. 광-펜톤 공정의 최적 $Fe^{2+}$$H_2O_2$ 투입량은 각각 0.0031 mmol과 0.625 mmol이었으며, 최적 pH는 3으로 나타났으나, 7이하의 pH 범위에서는 RhB 색 감소에 큰 영향을 미치지 않는 것으로 나타났다. 초기 반응 속도에 가장 큰 영향을 주는 인자는 UV 광 전력 > $H_2O_2$> 철염의 순으로 나타났다. 80분간의 반응시간 경과 후 최종 RhB 농도를 고찰한 결과 UV 광 전력이 낮을 경우 색도가 다 제거되지 않기 때문에 광-펜톤 공정에서 UV 광 전력이 색 제거에 대한 가장 큰 인자라고 사료되었다. 광-펜톤 공정의 개별 공정인 UV, $H_2O_2$, 펜톤을 이용하여 RhB의 농도감소를 고찰한 결과 초기 반응속도상수는 펜톤 공정의 빠른 초기 반응로 인해 펜톤 > UV >$H_2O_2$로 나타났으나, 최종 RhB 농도를 고려할 경우 UV> 펜톤 > $H_2O_2$로 나타났다.

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