• Title/Summary/Keyword: molecular distribution

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Phytosociological Study and Spatial autocorrelation on the Forest Vegetation of Mt. Yeonae at Gijang-gun

  • Choi, Byoung-Ki;Huh, Man Kyu
    • Journal of Environmental Science International
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    • v.22 no.11
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    • pp.1373-1381
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    • 2013
  • Mt. Yeonae is at Gijang-gun in Busan and is surrounded by farming lands on three sides. The search for the species composition and dynamics of local communities were studied at Mt. Yeonae of how spatial similarity decays with geographic distance. The index values of Z$\ddot{u}$rich-Montpellier School's phytosociology at the 12 plots was compared to a distribution of similarly using 20 m quadrates at 12 sites. The specific communities were five including Pinus densiflora - Quercus variabilis community. Six species were significant similarity between neighboring sites by using the spatial autocorrelation coefficient, Moran's I. If Mt. Yeonae was destroyed by an artificial action, some spatial correlated species such as P. densiflora and Q. variabilis will be collapsed because of no maintaining the effective population sizes.

The molecular dynamics study of TBAB hydrogen hydrate structure (TBAB를 첨가한 수소 하이드레이트의 분자 동역학 연구)

  • Choi, Seungho;Park, Chansu;Kim, Soomin;Woo, Sungmin;Shin, Jaeho;Kim, Yangdo
    • 한국신재생에너지학회:학술대회논문집
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    • 2010.11a
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    • pp.153.1-153.1
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    • 2010
  • 가스 하이드레이트는 낮은 온도와 높은 압력에서 물과 천연가스 분자가 물리적으로 안정한 결합을 하고 있는 결정질의 화합물이다. 현재 130개 이상의 가스분자들이 물분자와 결합하여서 Clathrate 하이드레이트를 형성하는 것으로 보고 되어 있다. 수소의 경우 하이드레이트를 형성하기 위해서 약 200MPa 이상의 높은 압력이 필요하다. TBAB는 semi-clathrate 하이드레이트를 형성하는 첨가제로 알려져 있으며 수소 하이드레이트의 형성 압력을 완화시키기 위한 촉진제로서 많은 연구가 수행되고 있다. Wataru Shimada는 XRD 패턴을 사용하여 semi-clathrate 하이드레이트의 특수한 결정 모델을 분석하였다. 이 모델의 경우, 대기압 하에서 TBAB와 물분자의 화학 양론적 비를 1:38로 제시하였다. 이는 처음으로 TBAB 하이드레이트 결정구조를 밝혀냈지만, 분자 동역학적 부문에서는 그 데이터가 정확히 정의 되지 않았다. 본 연구는 Wataru Shimada 모델을 수소 TBAB 하이드레이이트의 분자 동역학 연구에 적용시켰으며, 실험에서 나온 데이터를 바탕으로 RDF(Radial Distribution Function)와 MSD(Mean Square Displacement)를 측정했다.

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Physical property control for a batch polymerization reactor

  • Kim, In-Sun;Ahn, Sung-Mo;Rhee, Hyun-Ku
    • 제어로봇시스템학회:학술대회논문집
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    • 1996.10a
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    • pp.263-266
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    • 1996
  • A method to determine an optimal temperature trajectory that guarantees polymer products having controlled molecular weight distribution and desired values of molecular weight is presented. The coordinate transformation method and the optimal control theory are applied to a batch PMMA polymerization system to calculate the optimal temperature trajectory. Coordinate transformation method converts the original fixed-end-point, free-end-time problem to a free-end-point, fixed-end-time problem. The idea is that by making the reactor temperature track the optimal temperature trajectory one may be able to produce polymer products having the prespecified physical property in a minimum time. The on-line control experiments with the PID control algorithm have been conducted to establish the validity of the scheme proposed in this study. The experimental results show that prespecified polymer product could be obtained with tracking the calculated optimal temperature trajectory.

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Transient Response of The Optimal Taper-Flat Head Slider in Magnetic Storage Devices

  • Arayavongkul, R.;Mongkolwongrojn, M.
    • 제어로봇시스템학회:학술대회논문집
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    • 2004.08a
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    • pp.990-994
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    • 2004
  • This paper presents a method to predict the transient characteristic of the air lubricated slider head in a hard disk drive by using optimization technique. The time dependent modified Reynolds equation based on the molecular slip flow approximation equations was used to describe the fluid flow within the air bearing and the implicit finite difference scheme is applied to calculate the pressure distribution under the slider head. The exhaustive search combined with the Broyden-Fletcher-Goldfarb-Shanno method were employed to obtain optimum design variables which are taper angle, rail width and taper length in order to keep the forces and moments acting on the slider head in dynamic equilibrium. The results show that the optimal head slider of the magnetic head has good stability characteristic that can reach the steady state within 0.5 microsecond.

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Canonical Sampling Method for Initial Conditions for Reactive Flux Calculations Using Nose-Hoover Chains

  • Lee, Song-Hi;Pak, Young-Shang
    • Bulletin of the Korean Chemical Society
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    • v.25 no.4
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    • pp.533-538
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    • 2004
  • Canonical sampling method has been presented to generate the initial conditions for reactive flux studies of organic reactions in water. Velocity Verlet version of Nose-Hoover chain dynamics algorithm has been employed to sample the initial conditions according to canonical distribution. The unstable normal mode of a transition state has been introduced to define a dividing plane separating reactant and product regions in reaction processes. This method has been implemented and tested for the case iels-Alder reaction of methyl vinyl ketone (MVK) and cyclopentadiene (CPD) in water, providing a reliable tool for further reactive flux molecular dynamics studies in condensed media.

Poly-$\alpha$-methylstyrene Films by Plasma Polymerization(I) (플라즈마 중합된 Poly-$\alpha$-methylstyrene 박막(I))

  • Park, Sang-Hyun;Lee, Chwi-Cwung;Han, Sang-Ok;Lim, Youg-Hoon;Lee, Deok-Chool
    • Proceedings of the KIEE Conference
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    • 1991.11a
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    • pp.304-306
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    • 1991
  • A new gas-flow type reactor for plasma polymerization was developed to symthesize functional polymer, which enhances the reaction of radicals activated in discharge. $\alpha$-Methylstyrene was used for the polymerization, which are known as starting monomers for the polymer with degradating characteristics. The molecular structure and molecular weight distribution of the polymers were studied.

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The PSA Properties of n-Butyl Acrylate/Acrylic Acid Copolymer and Tackifier Resins with Influence of Miscibility (n-Butyl Acrylate/Acrylic Acid 공중합체와 점착부여제간의 상용성과 점착물성)

  • 민경은;김호겸;최관영;곽기호
    • Polymer(Korea)
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    • v.24 no.4
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    • pp.469-476
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    • 2000
  • The miscibility between acrylic copolymers and tackifier resins influenced on adhesion properties of PSA. PSA with high molecular weight and narrow molecular weight distribution of acrylic copolymers showed systemical modification of adhesion properties of PSA by tackifier resins only in case of miscible system. It is concluded that the investigation of the miscibility between two Components is very important to adhesion properties of PSA.

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Polymerization of Methyl Methacrylate with Nickel $\alpha$-Diimine Catalysts: Effect of the Methyl Position in the Ligand

  • Kim, Il;Kim, Jae-Sung;Han, Byeong-Heui;Ha, Chang-Sik
    • Macromolecular Research
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    • v.11 no.6
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    • pp.514-517
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    • 2003
  • In the solution polymerizations of methyl methacrylate with (${\alpha}$-diimine)nickel(II)/methylaluminoxane (MAO), we observed effects of the position of two methyl substituents in the ligand on both the activities of the catalysts and the polymer microstructure. ${\alpha}$-Diimine nickel(II) catalysts gave syndiotactic-rich poly(methyl methacrylate) with high molecular weight and narrow molecular weight distribution.

A Study on the Characteristics of Natural Organic Matter and Disinfection By-Product Formation in the Juam Reservoir

  • Shin, Dae-Yewn;Moon, Ok-Ran;Yoon, Mi-Ran;Kim, Nam-Joung;Kang, Gang-Unn;Seo, Gwang-Yeob
    • Proceedings of the Korean Environmental Health Society Conference
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    • 2005.06a
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    • pp.259-262
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    • 2005
  • This study aims to identify the relationship between characteristics of aqueous organic matter and chlorination by-products formation potential according to temporal effect of Juam reservoir in Sun-Choen. The molecular weight distribution and chemical composition of precursors and their relationship with disinfection by-products(DBPs) were investigated. Most of the organic matters was responsible for the major DBP precursors in the raw water are small compounds with a molecular weight less than IKDa, Aromatic contents determined by SUVA correlated well with DBPs, THMs, and HAAs formation. Especially, THMFP/DOC showed better correlation with SUVA than HAAFP/DOC and DBPFP/DOC with SUVA in Juam reservoir. Therefore, effective removal of small molecules or hydrophobic organic matter prior to disinfection process will significantly reduce the DBP concentration in the finished water.

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