• Title/Summary/Keyword: Chemical forms

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Thermodynamic Calculations on the Chemical Behavior of SrO During Electrolytic Oxide Reduction

  • Jeon, Min Ku;Kim, Sung-Wook;Lee, Sang-Kwon;Choi, Eun-Young
    • 방사성폐기물학회지
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    • 제18권3호
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    • pp.415-420
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    • 2020
  • Strontium is known as a salt-soluble element during the electrolytic oxide reduction (EOR) process. The chemical behavior of SrO during EOR was investigated via thermodynamic calculations to provide quantitative data on the chemical status of Sr. To achieve this, thermodynamic calculations were conducted using HSC chemistry software for various EOR conditions. It was revealed that SrO reacts with LiCl salt to produce SrCl2, even in the presence of Li2O, and that the ratio of SrCl2 depends on the initial concentration of Li2O dissolved in LiCl. It was found that SrO reacts with Li to produce Sr during EOR and that the reduced Sr reacts with LiCl salt to produce SrCl2. As a result, the proportions of metallic forms were lower in Sr than in La and Nd under various EOR conditions. The thermodynamic calculations indicated that the three chemical forms of SrO, SrCl2, and Sr co-exist in the EOR system under an equilibrium with Li, Li2O, and LiCl.

아연광산 주변 논토양에서 토양(土壤) 화학성(化學性)이 중금속의 형태(形態) 및 그 분포(分布)에 미치는 영향 (Effects of Soil Chemical Properties on the Distribution and Forms of Heavy Metals in Paddy Soils near Zine Mines)

  • 현해남;유순호
    • 한국토양비료학회지
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    • 제24권3호
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    • pp.183-191
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    • 1991
  • 본 연구는 아연광산(亞鉛鑛山) 주변의 논토양에 존재하는 Cd, Pb, Cu 및 Zn의 형태별 함량을 조사하여 중금속간의 분포(分布) 특성(特性)을 검토하였으며, 토양 화학적 성질이 이들의 형태별 함량 분포에 미치는 영향을 밝히기 위하여 수행되었다. 그 결과를 요약하면 다음과 같다. 1. 공시토양에 존재하는 Cd, Pb, Cu 및 Zn은 주로 해화물-잔류태(殘留態)로 존재하였으며, Cd와 Pb의 산화물(酸化物)-탄산염태(炭酸鹽態)와 Cu의 유기복합태(有機複合態)의 함량도 높은 편이었다. Pb와 Cu의 치환태는 소량 존재하였으며, 수용태는 Zn만 검출되었다. 2. 치환태의 분포비가 높은 토양일수록 산화물-탄산염태 및 황화물-잔류태의 분포비가 낮았다. 3. 토심이 깊어질수록 치환태 Cd 및 Zn의 분포비(分布比)는 낮아지고 항화물-잔류태의 분포비가 높아졌으며, Pb는 산화물-탄산염태의 분포비가 낮아지고 황화물-잔류태의 분포비가 높아졌다. 4. Cu는 유기물이 많은 토양일수록 Cu의 유기복합태 함량이 많았으며, Cd, Pb 및 Zn의 유기복합태는 유기물함량과 관계가 없었다. 치환태 Cd, Pb 및 Zn의 분포비는 pH가 높은 토양일수록 낮았으나, 이들의 산화물-탄산염태과 황화물-잔류태의 분포비의 합은 높았다. Pb의 산화물-탄산염태 및 황화물-잔류태의 분포비는 공시토양의 pH 전범위에서 Cd 및 Zn에 비하여 높았다.

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Chemical Composition, In vivo Digestibility and Metabolizable Energy Values of Caramba (Lolium multiflorum cv. caramba) Fresh, Silage and Hay

  • Ozelcam, H.;Kirkpinar, F.;Tan, K.
    • Asian-Australasian Journal of Animal Sciences
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    • 제28권10호
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    • pp.1427-1432
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    • 2015
  • The experiment was conducted to determine nutritive values of caramba (Lolium multiflorum cv. caramba) fresh, silage and hay by in vivo and in vitro methods. There was a statistically significant difference (p<0.01) in crude protein content value between fresh caramba (12.83%) and silage (8.91%) and hay (6.35%). According to results of experiment, the crude fiber, neutral detergent fiber, acid detergent fiber (ADF), acid detergent lignin contents of the three forms of caramba varied between 30.22% to 35.06%, 57.41% to 63.70%, 35.32% to 43.29%, and 5.55% to 8.86% respectively. There were no significant differences between the three forms of caramba in digestibility of nutrients and in vivo metabolizable energy (ME) values (p>0.05). However, the highest $ME_{CN}$ (ME was estimated using crude nutrients) and $ME_{ADF}$ values were found in fresh caramba (p<0.01). As a result, it could be said that, there were no differences between the three forms of caramba in nutrient composition, digestibility and ME value, besides drying and ensiling did not affect digestibility of hay. Consequently, caramba either as fresh, silage or hay is a good alternative source of forage for ruminants.

Eigenfunctions for Liouville Operators, Classical Collision Operators, and Collision Bracket Integrals in Kinetic Theory Made Amenable to Computer Simulations

  • Eu, Byung-Chan
    • Bulletin of the Korean Chemical Society
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    • 제33권3호
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    • pp.779-789
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    • 2012
  • In the kinetic theory of dense fluids the many-particle collision bracket integral is given in terms of a classical collision operator defined in the phase space. To find an algorithm to compute the collision bracket integrals, we revisit the eigenvalue problem of the Liouville operator and re-examine the method previously reported [Chem. Phys. 1977, 20, 93]. Then we apply the notion and concept of the eigenfunctions of the Liouville operator and knowledge acquired in the study of the eigenfunctions to cast collision bracket integrals into more convenient and suitable forms for numerical simulations. One of the alternative forms is given in the form of time correlation function. This form, on a further manipulation, assumes a form reminiscent of the Chapman- Enskog collision bracket integrals, but for dense gases and liquids as well as solids. In the dilute gas limit it would give rise precisely to the Chapman-Enskog collision bracket integrals for two-particle collision. The alternative forms obtained are more readily amenable to numerical simulation methods than the collision bracket integrals expressed in terms of a classical collision operator, which requires solution of classical Lippmann-Schwinger integral equations. This way, the aforementioned kinetic theory of dense fluids is made fully accessible by numerical computation/simulation methods, and the transport coefficients thereof are made computationally as accessible as those in the linear response theory.

Theoretical Studies on MXO4 (M=Li, Na, K and X=F, Cl, Br, I) Salt Ion Pairs

  • Rashid, Mohammad Harun Or;Ghosh, Manik Kumer;Choi, Cheol-Ho
    • Bulletin of the Korean Chemical Society
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    • 제31권8호
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    • pp.2215-2218
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    • 2010
  • The series of alkali metal perhalogenates, $MXO_4$ (M=Li, Na, K and X=F, Cl, Br, I) were theoretically studied with the help of MP2 methods. Bidentate as well as tridentate structures were found to be stable minima. The bidentate structures are becoming preferred as the size of halogen increases and as the size of metal decreases. Geometrically, the M-O and M-X distances of both bidentate and tridentate structures, increase with the size of metal. Generally, the M-$O_1$ distances of tridentate forms are longer than the corresponding distances of bidentate forms, while the M-X distances of tridentate forms show the opposite trend. Similarly, the X-O bonds increase with the size of halogens except $MXO_4$ pairs, where the X-O bonds are unusually long due to the enhanced oxygen-oxygen repulsions. In short, the relative energetics as well as the geometrical parameters are found to be strongly dependent on halogen and metal elements.

呈色詩藥의 發色에 미치는 陽이온 表面活性劑의 영향 (第1報). Zephiramine 의 存在下에서 여러가지 술포프탈레인 指示藥의 解離常數 (The Influence of the Cationic Surfactant on the Coloration of Chromogenic Reagents (I). The Dissociation Constants of Sulfophthalein Indicators in the Presence of Zephiramine)

  • 문수찬
    • 대한화학회지
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    • 제20권4호
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    • pp.270-276
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    • 1976
  • 양이온 표면활성제인 Zephiramine의 존재하에서 여러가지 술포프탈레인 지시약의 흡수스펙트럼과 해리상수를 측정하여 수용액에서의 값과 비교했다. 염기성적색형은 흡수 극대가 6${\sim}$21 nm 장파장쪽으로 이동하며 흡수도는 약간 증가하는 반면, 황색형은 흡수극대가 오히려 4${\sim}$20 nm 단파장으로 이동하고 흡수도도 약간 감소했다. pKa값은 -1.38${\sim}$0.37정도 변화했다. 이와같은 정색반응을, 색소분자가 미셀 표면에 흡착됨으로서 더 안정한 공면구조를 형성하기 때문이라는 가정으로 설명했다.

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구리수은막 전극에을 사용한 이소니아자이드의 전위차 역적정 (Potentiometric Back Titration of Isoniazid in Pharmaceutical Dosage Forms Using Copper Based Mercury Film Electrode)

  • Gajendiran, M.;Nazer, M.M. Abdul Kamal
    • 대한화학회지
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    • 제55권4호
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    • pp.620-625
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    • 2011
  • 구리수은막 전극(CBMFE)으로 전위차 역적정함으로써 이소니아자이드(INH)를 정량하는 간단하고 빠른 방법이다. 순수한 형태와 투약형태에 대해서 1.0-10.0 mg 범위에서 정량 할 수 있도록 적정조건을 설정하였다. 방법의 정밀도와 정확도는 통계적인 방법으로 평가되었으며, 정제와 시럽속에 함유된 INH 정량법은 F-시험과 t-시험을 통하여 영국약전(BP) 방법과 비교하였다.

Photochromism of A Styrene-Derived Polymer Having Pendant Phenoxyanthraquinones

  • Ju, Sang-Yong;Ahn, Kwang-Duk;Han, Dong-Keun;Suh, Dong-Hack;Kim, Jong-Man
    • Journal of Photoscience
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    • 제7권4호
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    • pp.131-133
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    • 2000
  • A Styrene-derived polymer having pendent phenoxyanthraquinones for photochromism was prepared by AIBN-initiated radical polymerization. Syntgesus of the monomers was straightforward and the polymer was obtained in 65% yield. Photoinduced rearrangement from the “trans” quinone forms to the “ana” quinone forms readily occurred both in solution and in film when the polymer was irradiated with UV light.

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Mesoporous Thin Films with Accessible Pores from Surfaces

  • Lee, U-Hwang;Kim, Min-Hye;Kwon, Young-Uk
    • Bulletin of the Korean Chemical Society
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    • 제27권6호
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    • pp.808-816
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    • 2006
  • Among the many forms of mesoporous materials, thin films are important for the potential applications of this class of materials. Compared with the powder forms, however, there has been relatively little work done on thin films probably because of the lack of suitable and generalized synthetic mechanisms established. In this account, we will review the issues on mesoporous thin films with emphasis on the necessity of forming films with accessible pores from the film surfaces and on mesoporous thin films with metal oxides other than silica. Various methods that have been tried to utilize mesoporous thin films with accessible pores as templates for the synthesis of nanostructured materials are reviewed with the emphasis on the advantages of the electrochemical deposition technique.

Effects of Microsolvating Water on the Stability of Zwitterionic vs. Canonical Diglycine

  • Kim, Ju-Young;Won, Gang-Yeon;Lee, Sungyul
    • Bulletin of the Korean Chemical Society
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    • 제35권3호
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    • pp.798-804
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    • 2014
  • We present calculations for diglycine - $(H_2O)_n$ (n = 0-3) to examine the effects of microsolvating water on the relative stability of the zwitterionic vs. canonical forms of the dipeptide. We calculate the structures, energies and Gibbs free energies of the conformers at wB97XD/6-311++G** and MP2/aug-cc-pvdz levels of theory level of theory. We predict that microsolvation by up to three water molecules does not give thermodynamic stability of the zwitterion relative to the canonical forms. Our calculations also suggest that zwitterionic diglycine - $(H_2O)_3$ is not stable kinetically in low temperature gas phase environment.