• 제목/요약/키워드: nonlinear chemical process

검색결과 84건 처리시간 0.023초

유/무기 졸-겔 재료에 비선형광학 물질의 배향특성에 대한 액정효과 (Liquid crystal effects on poling behaviour of NLO chromophore dispersed in organically modified sol-gel materials)

  • Baek, In-Chan;Seok, Sang-Il;Jin, Moon-Young;Lee, Chang-Jin
    • 한국재료학회:학술대회논문집
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    • 한국재료학회 2003년도 추계학술발표강연 및 논문개요집
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    • pp.132-132
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    • 2003
  • Second-order nonlinear optical(NLO) materials have been extensively studied for applications in photonic devices, such as frequency doubling and electro-optical(EO) modulation, because of their large optical nonlinearity, excellent processibility, low dielectric constant, and high laser damage thresholds. The poling behaviour of NLO chromophore in organic/inorganic matrixes showed the randomization of poled NLO chromophore in the absence of poling Held. The liquid crystal molecules in a droplet showed a long-range orientational order along a director. Therefore, liquid crystal effects on poling behaviour of NLO chromophore dispersed in organically modified inorganic sol-gel materials were investigated. Using sol-gel process for the development of NLO material has received increasing attention, Organically modifked inorganic NLO sol-Eel materials are obtained via incorporation of the organic NLO active chromophore into an alkoxysilane based inorganic network. One of the most important thing in this works was that tetraethoxysilane(TEOS) and methyltrimathoxysilane(HTMS) were used as precursor followed by hydrolysis and condensation without using any acidic catalyst during the process. The NLO chromophores in the liquid crystal nanodomains were well mixed with I/O hybrid matrix, deposited on transparent ITO-coated glasses. The poling behaviour of liquid crystal effects of NLO chromophore dispersed in I/O hybrid matrix were investigated by UV-vis spectroscopy. Size distribution and morphology of the NLO chromophores doped in the liquid crystal nanodomains dispersed in I/O hybrid matrix were investigated by SEM.

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Analysis of the effect of flow-induced crystallization on the stability of low-speed spinning using the linear stability method

  • Shin Dong Myeong;Lee Joo Sung;Jung Hyun Wook;Hyun Jae Chun
    • Korea-Australia Rheology Journal
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    • 제17권2호
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    • pp.63-69
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    • 2005
  • The stability of low-speed spinning process exhibiting spinline flow-induced crystallization (FIC) with no neck-like spinline deformation has been investigated using the method of linear stability analysis. Effects of various process conditions such as fluid viscoelasticity and the spinline cooling on the spinning stability have been found closely related to the development of the spinline crystallinity. It also has been found that the FIC makes the system less stable or more unstable than no FIC cases when the spinline crystallinity reaches its maximum possible value, whereas the FIC generally stabilizes the system if the crystallinity doesn't reach its maximum value on the spinline. It is believed that the destabilizing effect of the FIC on low-speed spinning when the crystallinity is fully developed on the spinline is due to the reduction of the real spinning length available for deformation on the spinline. On the other hand, the increased spinline tension caused by the FIC when the maximum crystallinity is not reached on the spinline and thus no reduction in the spinning length occurs, makes the sensitivity of spinline variables to external disturbances smaller and hence stabilizes the system. These linear stability results are consistent with the findings by nonlinear transient simulation, as first reported by Lee et al. (2005b).

공극스케일에서의 시뮬레이션을 통한 암석물성의 이해와 예측 (Understanding and predicting physical properties of rocks through pore-scale numerical simulations)

  • 김영석
    • 한국지구물리탐사학회:학술대회논문집
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    • 한국지구물리탐사학회 2006년도 공동학술대회 논문집
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    • pp.201-206
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    • 2006
  • 지구과학은 지구와 지구시스템을 기술(description)하던 기존의 역할에서 벗어나, 진화하는 지구 시스템 안에서 일어나는 프로세스의 모델링(process modeling), 시뮬레이션(simulation) 그리고 이러한 현상들을 구상화(visualization)하는 방향으로 그 접근 방법이 서서히 그러나 매우 역동적으로 변화하고 있다. 하지만 이러한 모델링 및 시뮬레이션은 현대의 컴퓨터 기술의 발달에도 불구하고 그 수행이 쉽지는 않다. 그 이유로는 지구의 현상들은 그 현상의 기초원인이 되는 물리적 화학적 프로세스들이 비선형적이며, 서로 다른 프로세스들이 상호 연동되어 발생하고, 시간에 따라 변화를 보이기 때문이다. 더구나 이러한 복잡한 프로세스들이 암석의 공극구조라는 매우 복잡한 구조 안에 일어날 때, 그 현상의 모델링 및 시뮬레이션은 그 어려움이 더욱 커지게 된다.따라서 이러한 지구시스템의 여러 가지 프로세스들에 대한 효과적인 모델링 및 시뮬레이션을 위해선 지구의 기본 구성단위인 암석의 구조, 즉 복잡한 공극구조의 이해 및 그 형태를 효과적으로 컴퓨터상에서 수치적으로 기술하는 방법의 개발이 선행되어야 한다. 본 발표에서는 이러한 공극스케일의 모델링을 위한 격자볼츠만 방법, 유한요소법을 이용한 수치방법과 그 결과와, 지구의 여러가지 비선형적이고 시간종속적인 프로세서의 모델링에의 응용가능성에 대한 내용을 제시한다.

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MORPHOLOGICAL CHARACTERISTICS OF NONLINEAR OPTICAL MOLECULES AT THE AIR/WATER INTERFACE

  • Lim, Sung-Taek;Park, Mi-Kyung;Shin, Dong-Myung;Kwon, Ohoak
    • Journal of Photoscience
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    • 제5권1호
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    • pp.11-15
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    • 1998
  • The texture change of non-linear optical molecules at the air/water interface was investigated as a function of surface pressure with Brewster angle microscopy. The texture change resulted from the aggregation of dye molecules is important to understand the film uniformity and grain formation process. The 4-Octadecylhydroxy-4'-nitrostilbene (OHNS) generated the small spots of size around 1$\mu$m. The spots exhibit high contrast with other film area and do not show angle dependent reflectivity change. It is interesting to observe that the size of the domain stays the same as the film pressure increases. At high surface pressure, the contrast ratio of domains becomes high, which means dense packing of OHNS. And, the size of domain grows. In the middle of domain, highly contrasted domains are formed. The first and the second order transitions of OHNS observed from surface pressure-area isotherm result from the two types of grains. The N,N-Dihexadecylcyanoaniline (DHCA) formed highly contrasted gains over entire region, and the grains are the double layers. The difference in Langmuir film of OHNS and DHCA at the air/water interface is consistent with the small tilt angle from the surface normal for OHNS and the large tilt angle for DHCA in the Langmuir-Blodgett films.

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Reagentless Determination of Human Serum Components Using Infrared Absorption Spectroscopy

  • Hahn, Sang-Joon;Yoon, Gil-Won;Kim Gun-Shik;Park Seung-Han
    • Journal of the Optical Society of Korea
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    • 제7권4호
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    • pp.240-244
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    • 2003
  • Simultaneous determination of concentrations for four major components in human blood serum was investigated using a Fourier-transform mid-infrared spectroscopy. Infrared spectra of human blood serum were measured in 8.404 ∼ 10.25 ${\mu}m$ range where the highest absorption peaks of glucose are located. A partial least square (PLS) algorithm was utilized to establish a calibration model for determining total protein, albumin, globulin and glucose levels which are commonly measured metabolites. The standard error of cross validation obtained from our multivariate calibration model was 0.24 g/dL for total protein, 0.15 g/dL for albumin, 0.17 g/dL for globulin, and 6.68 mg/dL for glucose, which are comparable with or meet the criteria for clinical use. The results indicate that the infrared absorption spectroscopy can be used to predict the concentrations of clinically important metabolites without going through a chemical process with a reagent.

통계학적 실험계획법을 이용한 수소정제용 UiO-66 흡착제 개발 (Development of Adsorption Process with UiO-66 Particles for Hydrogen Purification Using Statistical Design of Experiment)

  • 이현식;김다솜;박지원;유계상
    • Korean Chemical Engineering Research
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    • 제56권6호
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    • pp.784-791
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    • 2018
  • 다양한 합성조건에서 UiO-66 입자를 합성하여 수소정제용 이산화탄소 흡착량에 대한 연구를 수행하였다. 이를 위하여 통계학적 실험계획법을 이용하여 실험계획을 세우고 도출된 결과를 이용하여 분석하였다. 합성시간, 온도 및 아세트산의 용량이 증가할 수록 UiO-66입자의 결정도가 증가하였다. 특히 아세트산의 용량이 입자의 결정도를 결정하는데 중요한 인자로 확인되었다. 질소흡착법으로 측정한 입자의 비표면적의 경우도 유사한 경향을 보였다. 실험계획법 중 일반요인분석을 이용하여 주요 인자에 대한 주효과도 및 교호작용을 분석하였다. 또한 비선형 회귀법을 이용하여 이산화탄소 흡착량을 예측하였고, 모든 범위에서 대하여 흡착성능을 표면도와 등고선도를 통해 제시하였다.

가우시안 프로세서 회귀 기반의 비선형 구조방정식을 활용한 고분자 물성거동 예측 연구 (Study of Polymor Properties Prediction Using Nonlinear SEM Based on Gaussian Process Regression)

  • 문경렬;박건욱
    • 정보처리학회논문지:컴퓨터 및 통신 시스템
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    • 제13권1호
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    • pp.1-9
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    • 2024
  • 고분자 분야의 개발 및 양산과정에는 제어가 안되는 많은 변수가 있으며, 화학적 조성, 구조, 가공 조건 등 작은 변화에도 물성편차가 크게 발생하기에 보편적인 환경을 가정한 기존의 선형적 모델링 기법으로는 현장 데이터 적용시 많은 오차가 발생한다. 이에 본 연구에서는 최근 산업용 구동부품의 플라스틱 채용경향에 맞추어 엔지니어링 플라스틱인 Polyacetal 수지의 내마모성 및 내굴곡성 강화 연구에 다변량 분석기법인 구조방정식과 가우시안 프로세스 회귀를 결합한 모델링 방식(GPR-SEM)을 제안하고, 비선형성을 가지는 물질 모델링에 활용 가능성을 고찰하고자 한다.

Nucleation and Growth of Bismuth Electrodeposition from Alkaline Electrolyte

  • Zhou, Longping;Dai, Yatang;Zhang, Huan;Jia, Yurong;Zhang, Jie;Li, Changxiong
    • Bulletin of the Korean Chemical Society
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    • 제33권5호
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    • pp.1541-1546
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    • 2012
  • The early stages of bismuth (Bi) electrodeposition on glass carbon electrode from alkaline electrolyte were studied by cyclic voltammetry, chronoamperometry, scanning electron microscopy, atomic force microscopy and X-ray diffraction. The CV analysis showed that the electrodeposition of Bi was determined to be quasireversible process with diffusion controlled. The current transients for Bi electrodeposition were analyzed according to the Scharifker-Hills model and the Heerman-Tarallo model. It can be concluded that the nucleation and growth mechanism was carried out under a 3D instantaneous nucleation, which was confirmed by SEM analysis. The kinetic growth parameters were obtained through a nonlinear fitting. In addition, the Bi film obtaining at -0.86 V for 1 hour was of compact and uniform surface with good smoothness, small roughness and a very high purity. The Bi film were indexed to rhombohedral crystal structure with preferred orientation of (0 1 2) planes to growth.

Kinetics and Mechanism of the Pyridinolysis of Aryl Phenyl Chlorothiophosphates in Acetonitrile

  • Hoque, Md. Ehtesham Ul;Dey, Shuchismita;Kim, Chan-Kyung;Lee, Hai-Whang
    • Bulletin of the Korean Chemical Society
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    • 제32권4호
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    • pp.1138-1142
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    • 2011
  • Kinetic studies for the reactions of Y-aryl phenyl chlorothiophosphates with X-pyridines have been carried out in acetonitrile at $35.0^{\circ}C$. The Hammett and Bronsted plots for substituent X variations in the nucleophiles are biphasic concave upwards with a break point at X = 3-Ph, while the Hammett plots for substituent Y variations in the substrates are biphasic concave downwards (and partially upwards) with a break point at Y = H. The signs and magnitudes of the cross-interaction constant (${\rho}_{XY}$) are strongly dependent upon the nature of substituents, X and Y. The proposed mechanism is a stepwise process with a rate-limiting step change from bond breaking with the weaker electrophiles to bond formation with the stronger eletrophiles. The nonlinear free energy correlations of biphasic concave upward plots for substituent X variations in the nucleophiles are rationalized by a change in the attacking direction of the nucleophile from a backside with less basic pyridines to a frontside attack with more basic pyridines.

A Study on Optimal Design of Single Periodic, Multipurpose Batch Plants

  • Rhee, In-Hyoung;Cho, Dae-Chul
    • 한국산학기술학회논문지
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    • 제3권1호
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    • pp.10-19
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    • 2002
  • 본고는 다종, 소규모 회분식 공정 또는 공장을 수학적 프로그래밍 기법으로 최적 설계하는 방법에 대한 것이다. 제안된 일반 회분식 공장문제는 Papageorgaki와 Reklaitis에 의해 혼합정수비선형식(MINLP)으로 수립된 것인데, 최적해답을 보장하며 공장의 확장 등 불확실성을 고려하여 선형화 한 후(MILP) 푸는 방법론이 제시되었다. Bende식 문제분할 방식을 개조하여 몇가지 예제에 대한 풀이를 제시하였다. IBM의 OSL 최적화 패키지를 이용하였고 MILP를 직접 푸는 경우보다 계산시간을 크게 단축할 수 있었다.

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