• Title/Summary/Keyword: Charge-transfer interaction

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Red Organic Light-emitting Diodes utilizing Energy Transfer and Charge Trapping

  • Kim, Ju-Seung;Gu, Hal-Bon
    • Transactions on Electrical and Electronic Materials
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    • 제6권3호
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    • pp.91-96
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    • 2005
  • We report the efficient red light-emitting diodes based on the fluorescent dye 4-(dicyanomethylene)-2-i-propyl-6-(1,1,7,7-tetramethyljulolidyl-9-enyl)-4H-pyran (DCJTI) and 5,6,11,12-tetraphenyl naphthacene (rubrene) codoped in the tris(8-hydroxyquinoline)aluminum $(Alq_3)$. Luminance efficiency of 2.2 cd/A with a Commission International De L'Eclairage (CIE) chromaticity coordinate of x, y = (0.640, 0:350) are achieved at the driving current density of $20\;mA/cm^2$. Adding the rubrene to the DCJTI in tris(8-hydroxyquinoline)aluminum $(Alq_3)$, the red color purity and luminance efficiency improved comparing to the DCJTI only doped devices because the rubrene molecules assist the polarization effect of DCJTI by molecular interaction and enhance the energy transfer from $(Alq_3)$ to DCJTI.

A Novel Simulation Architecture of Configurational-Bias Gibbs Ensemble Monte Carlo for the Conformation of Polyelectrolytes Partitioned in Confined Spaces

  • Chun, Myung-Suk
    • Macromolecular Research
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    • 제11권5호
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    • pp.393-397
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    • 2003
  • By applying a configurational-bias Gibbs ensemble Monte Carlo algorithm, priority simulation results regarding the conformation of non-dilute polyelectrolytes in solvents are obtained. Solutions of freely-jointed chains are considered, and a new method termed strandwise configurational-bias sampling is developed so as to effectively overcome a difficulty on the transfer of polymer chains. The structure factors of polyelectrolytes in the bulk as well as in the confined space are estimated with variations of the polymer charge density.

폴리벤조옥사졸 전구체의 광투과도 연구 (Optical Transmittance of Polybenzoxazole Precursor)

  • 김대겸;김종화;최길영;오재민;이무영;박동원;이광섭;진문영
    • 폴리머
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    • 제26권1호
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    • pp.18-27
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    • 2002
  • 폴리벤조옥사졸 전구체로써 poly(ο-hydroxyamide)를 2,2'-bis(3-amino-4-hydroxy phenyl)hexafluoropropane과 여러 가지 bis-acid를 사용하여 축중합법에 의해 합성하였으며, 또한 이를 3,4-dihydro-2H-pyran과 부가반응시켜 산민감기인 tetrahydropyran이 부착된 방향족 폴리아미드를 합성하였다. Bis-acid의 구조에 따른 365 nm의 파장에서의 광투과도를 조사한 결과, 4,4'-oxydibenzoic acid로부터 합성된 중합체의 광투과도가 가장 우수하였다. 이러한 현상은 전자받게 성질을 갖고 있는 his-acid에 전자를 공여할 수 있는 구조를 도입하면 전자받게 성질이 감소되어 분자내 전하 이동 착물 (intra-CTC) 형성이 감소됨에 따라 광투과도가 증가된다고 사료된다. 또한 산민감기의 치환율이 높을수록 광투과도가 증가하는 경향을 보였다. 이는 방향족 폴리아미드에 산민감기인 THP의 치환율이 높아질수록 사슬과 사슬간의 조밀함이 떨어지기 때문에 분자간 전하 이동 착물 (inter-CTC) 형성을 줄여주는 효과를 얻게 되어 광투과도가 증가된다고 사료된다.

여러고리 방향족 화합물과 요오드 사이의 전하이동 착물생성에 관한 열역학적 연구 (Thermodynamics of the Formation of Polynuclear Aromatics-Iodine Charge Transfer Complexes)

  • 권오천;김정림;이영훈
    • 대한화학회지
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    • 제29권6호
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    • pp.575-581
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    • 1985
  • 벤젠, 나프탈렌 및 페난스렌과 요오드 사이의 각계를 사염화 탄소 용액에서 자외선 분광광도법에 의하여 연구한 결과 1:1분자 착물이 형성됨을 알았다. 이들 착물 생성에 의한 흡수 최대는 온도가 상승함에 따라 blue shift되므로 이에 따른 각 온도에서의 평형 상수를 구하였다. 이 값으로부터 이들 착물 생성에 대한 열역학적 파라미터를 산출한 결과 각 온도에서 여러 고리 방향족화합물과 요오드 사이에 생성된 착물의 상대적 안정도는 방향족 고리의 수가 증가함에 따라 증가함을 알 수 있다. 이러한 사실을 요오드에 대한 여러 고리 방향족 화합물들의 상대적 염기성도를 나타내며 방향족 화합물과 요오드 사이의 상호작용에 관한 공명현상에 의하여 설명할 수 있다. 그리고 이 계열의 연구결과를 폴리메틸 벤젠계열의 연구결과와 비교 고찰하였다.

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전하이동 착물형성에 의한 Ephedrine Alkaloids의 분석화학적 연구 (Spectrophotometric Determination of Ephedrine Alkaloids by Charge-Transfer Complexation)

  • 옥치완;백채선
    • 약학회지
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    • 제31권5호
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    • pp.330-337
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    • 1987
  • The weak UV absorbing ephedrine alkaloids such as ephedrine, pseudoephedrine, methylephedrine and norephedrine could be analyzed by charge-transfer spectrophotometric method. The results obtained are summarized as follows: (1) It was possible to determine a weak UV absorbing ephedrine alkaloids using the intense charge-transfer UV bands in chloroform. (2) This method was suitable for the spectrophotometric determination of ephedrine alkaloids in mixed pharmaceutical preparation. (3) Linear relationship was found between absorbance and concentration in the range of 1.0$\times$$10^{-5}M$~5$\times$$10^{-5}M$ of ephedrine ($\varepsilon$= 2.72$\times$$10^{4}LM^{-1}cm^{-1}$ and pseudoephedrine ($\varepsilon$=2.84$\times$$10^{4]LM^{-1}cm^{-1}$), 1.0$\times$$10^{-5}M$~5$\times$$10^{-5}$M of methylephdrine ($\varepsilon$=1.68$\times$$10^{4}LM^{-1}cm^{-1}$) and 1/3$\times$$10^{-4}M$~4/3$\times$$10^{-4}M$ of norephedrine ($\varepsilon$=0.74$\times$$10^{4}LM^{-1}cm^{-1}$. (4) CT- complex of ephedrine, pseudoephedrine and methylephedrine has absorption maxima at 293nm and norephedrine have absorption maximum at 253nm. (5) CT-complexes were formed in a 1:1 ratio between ephedrine alkaloids and iodine in chloroform. (6) By UV, IR, and $^1H$-NMR spectra, it could be inferred that CT-complexes were formed by interaction between the basic nitrogen of ephedrine alkaloids as electron (n) donor and iodine as electron ($\sigma$) acceptor.

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Fluorescence Behavior Associated with a Possible Intercolumnar Charge-transfer Interaction in the Crystalline State of a Dyad Consisting of Mesitylene and 1,4-Dicyano-2-methylnaphthalene Subunits

  • Ohta, Eisuke;Kobayashi, Hitoshi;Sakai, Atsushi;Matsui, Yasunori;Sato, Hiroyasu;Ikeda, Hiroshi
    • Rapid Communication in Photoscience
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    • 제4권2호
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    • pp.31-33
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    • 2015
  • Fluorescence (FL) properties of a novel donor-acceptor dyad, comprised of mesitylene and 1,4-dicyano-2-methylnaphthalene (DCMN) subunits connected by an ether linkage, were elucidated. The dyad in cyclohexane exhibits FL arising from an intramolecular exciplex. In the crystalline state, the dyad does not emit light from intra- and inter-molecular exciplexes but rather displays FL that is nearly equivalent to that of 2-methoxymethyl-substituted DCMN. However, the emission spectrum of the crystalline dyad contains a shoulder in the long wavelength region, suggesting that weak intercolumnar charge-transfer interactions take place between columns consisting of the mesitylene and DCMN subunits.

카드뮴(II)-플라보노이드 킬레이트 반응에 관한 연구 (Studies on the Cd(II)-Flavonoid Chelation Reactions)

  • 이정호;신선우;백승화
    • 약학회지
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    • 제54권1호
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    • pp.13-21
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    • 2010
  • The interaction of cadmium (II) ion with quercetin, qurecitrin and (+)-catechin was investigated in aqueous solution at various pH. The flavonoid/cadmium stochiometries for cadmium (II) binding to flavonoid have been determined by UV-visible spectroscopy. 1:1 Cd(II)-Flavonoid complex had a maximum absorbance and showed the bathochromic shift of the long-wavelength band of the UV-vis spectra in the alkaline pH, that occurs upon complexation, is due to a ligand-tometal charge transfer. The optimal concentration of Cd(II)-flavonoid complexes showed that complexation reaction could be classified in the following way: 55.27 ${\mu}M$ catechin > 54.72 ${\mu}M$ quercetin > 53.52 ${\mu}M$ quercitrin at the chelating site level. These results suggest that Cd(II)-flavonoid complex has the optimal condition of chelation in 0.2 M $NH_3$ - 0.2 M $NH_4Cl$ (pH 8.0) solution.

Photophysical Properties of 1,3-Dimethylnaphtho[1,2-e]uracil

  • Shim, Sang-Chul;Shin, Eun-Ju;Park, Seung-Ki;Kang, Ho-Kwon
    • Bulletin of the Korean Chemical Society
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    • 제7권3호
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    • pp.196-200
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    • 1986
  • The solvent change and salt do not affect the fluorescence quantum yield of 1,3-dimethylnaphtho[1,2-e]uracil indicating the considerable energy gap between the lowest singlet $({\pi},\;{\pi}^{\ast})\;and\;(n,\;{\pi}^{\ast})$ states in the compound. The results are consistent with the strong quenching of fluorescence by ethyl iodide. Fluorescence quantum yield is nearly independent of temperature, probably due to the relatively inefficient internal conversion. Unusual spectral difference is observed in isopentane and ethanol at 77K. The temperature dependence of emission in isopentane and in ethanol suggests that the increase of charge transfer character by the conformational change in isopentane leads to the structureless and red-shifted fluorescence, while in ethanol the decrease of the charge transfer character by the hydrogen bonding interaction results in the structured and blue-shifted fluorescence along with phosphorescence at the low temperature. Temperature dependence of emission in poly(methylmethacrylate) matrix indicates that $T_1{\to}S_0$ radiationless decay is an important process responsible for the strong temperature dependence of phosphorescence.

Toward Charge Neutralization of CVD Graphene

  • Kim, Soo Min;Kim, Ki Kang
    • Applied Science and Convergence Technology
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    • 제24권6호
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    • pp.268-272
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    • 2015
  • We report the systematic study to reduce extrinsic doping in graphene grown by chemical vapor deposition (CVD). To investigate the effect of crystallinity of graphene on the extent of the extrinsic doping, graphene samples with different levels of crystal quality: poly-crystalline and single-crystalline graphene (PCG and SCG), are employed. The graphene suspended in air is almost undoped regardless of its crystallinity, whereas graphene placed on an $SiO_2/Si$ substrate is spontaneously p-doped. The extent of p-doping from the $SiO_2$ substrate in SCG is slightly lower than that in PCG, implying that the defects in graphene play roles in charge transfer. However, after annealing treatment, both PCG and SCG are heavily p-doped due to increased interaction with the underlying substrate. Extrinsic doping dramatically decreases after annealing treatment when PCG and SCG are placed on the top of hexagonal boron nitride (h-BN) substrate, confirming that h-BN is the ideal substrate for reducing extrinsic doping in CVD graphene.

Atomic Study of Oxidation of Si(001) surface by MD Simulation

  • Pamungkas, Mauludi Ariesto;Kim, Byung-Hyun;Joe, Min-Woong;Lee, Kwang-Ryeol
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2009년도 제38회 동계학술대회 초록집
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    • pp.360-360
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    • 2010
  • Very initial stage of oxidation process of Si (001) surface was investigated using large scale molecular dynamics simulation. Reactive force field potential was used for the simulation owing to its ability to handle charge variation associated with the oxidation reaction. To know the detail mechanism of both adsorption and desorption of water molecule (for simulating wet oxidation), oxygen molecule (for dry oxidation) and their atom constituents, interaction of one molecule with Si surface was carefully observed. The simulation is then continued with many water and oxygen molecules to understand the kinetics of oxide growth. The results show that possibilities of desorption and adsorption depend strongly on initial atomic configuration as well as temperature. We observed a tendency that H atoms come relatively into deeper surface or otherwise quickly desorbed away from the silicon surface. On the other hand, most oxygen atoms are bonded with first layer of silicon surface. We also noticed that charge transfer is only occur in nearest neighbor regime which has been pointed out by DFT calculation. Atomic structure of the interface between the oxide and Si substrate was characterized in atomic scale.

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