• Title/Summary/Keyword: Lattice simulation

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Molecular Dynamics Simulation for Monolayers of Alkyl Thiol Molecules at Air-Solid Interfaces

  • 이송희;김한수
    • Bulletin of the Korean Chemical Society
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    • v.17 no.8
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    • pp.700-706
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    • 1996
  • We present the results of molecular dynamics simulations of monolayers of long-chain alkyl thiol [S(CH2)15CH3] molecules on an air-solid interface using the extended collapsed atom model for the chain-molecule and a gold surface for the solid surface. Several molecular dynamics simulations have been performed on monolayers with areas per molecule ranging from 18.30 to 32.10 Å2/molecule. It is found that there exist three possible transitions: a continuous transition characterized by a change in molecular configuration without change in lattice structure, a sudden transition characterized by the distinct lattice defects and perfect islands, and a third transition characterized by the appearance of a random, liquid-like state. The analysis of probability distributions of the segments shows that the structure of the chain-molecules at the air-solid interface is completely different from that at the air-water interface in the view of the degree of overlap of the probability distributions of the neighbor segments. The calculated diffusion coefficients of the chain-molecules on the monolayers seem to be not directly related to any one of the three transitions. However, the large diffusion of the molecules enhanced by the increment of the area per molecule may induce the second transition.

Analysis of Ventricular Electromechanical Characteristics by Lesions in Sudden Myocardial Infraction: Computer Simulation Study (급성 심근경색 병변에 따른 심실의 전기 역학적 특성 분석: 컴퓨터 시뮬레이션 연구)

  • Baek, Dong Geun;Jeong, Da Un;Lim, Ki Moo
    • Journal of Biomedical Engineering Research
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    • v.38 no.6
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    • pp.313-320
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    • 2017
  • Myocardial infarction is a disease caused by stenosis of the coronary arteries. The high risk of sudden cardiac death due to myocardial infarction has triggered related researches that have been actively studied so far. However, these studies focused on the clinical results, which are mainly based on observations of symptoms due to infarction through electrocardiograms. Therefore, in this study, we tried to analyze the behavior of heart according to the position and volume of infarction lesion through the computer simulation study using three dimensional ventricular models. In order to implement infarction, commercial software was used to simulate cell necrosis due to blockage of a specific coronary. In addition, the conduction block due to infarction was mimicked by reducing the electrical conduction in the infarcted area, which was 100 times less than the electrical conduction of the whole ventricular lattice implemented by the finite element analysis method. Thus, this study classified the infarcted cases into the upper, middle, lower, and apex according to lattice data of eight different infraction areas. In other words, we assumed that myocardial infarction would have inherent electro-dynamic characteristics depending on the location and extent, and analyzed the ventricular electromechanical responses for infarction lesions using a three dimensional cardiac physiome model. The results showed that the volume of infarction did not directly affect the cardiac responses, but the location of the infarction lesions could influence the ventricular pumping efficiency. These suggest that the occlusion of specific coronary arteries may have a fatal effect on the decline in ventricular performance. In conclusion, although location of myocardial infarction lesions is considered to be an important variable to be considered clinically rather than lesion size, quantitative predictions should be made more in the future considering physiological factors such as lesion location and direction of myocardial fiber at that location.

Analysis and Simulation of Ultrasonic Wave Propagation and Scattering in Unidirectional Fiber Composites (단일방향 섬유 복합재료 내의 초음파 전파 및 산란 현상의 해석과 시뮬레이션)

  • Lee, Choon-Jae;Yim, Hyun-June
    • Journal of the Korean Society for Nondestructive Testing
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    • v.21 no.3
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    • pp.269-276
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    • 2001
  • Ultrasonic testing of composite materials is much more difficult than that of isotropic materials, because of the beam skew phenomenon caused by their elastic anisotropy. An established analytical method exists for elastic wave propagation in anisotropic media as a result of previous research efforts. Yet, due to the complexity of the analytical method, solution of real problems must resort to the numerical method. In this work, analytical solutions have first been obtained for the wavefield due to a point source in a unidirectional fiber-reinforced composite, which may be modeled as transversely isotropic. Then, the corresponding numerical solutions have been obtained using the mass-spring lattice model(MSLM). The two solutions have agreed well with each other. Other problems such as reflection from free boundaries and scattering from cracks have also been solved numerically, and the results have been investigated from the viewpoint of wave mechanics. The numerical model whose validity has been confirmed by this work will be of great use in simulating ultrasonic testing of composite materials.

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A Particle-Grid Method for Efficient Sound Synthesis of Ocean Waves

  • Jong-Hyun Kim
    • Journal of the Korea Society of Computer and Information
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    • v.29 no.10
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    • pp.157-164
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    • 2024
  • In this paper, we propose a technique that utilizes the physical properties of foam particles to synthesize foam sounds and efficiently control their size. A typical way to represent sound in physics-based simulation environments is to generate and synthesize virtual sounds. In particular, foam particles have a large number of particles, so synthesizing sounds using only particles is computationally expensive, and a way to reduce the amount of computation is to use spatial information, lattices. In this paper, we present a method for reliably mapping and clustering foam particles into a lattice space. Furthermore, we utilize this structure to control the loudness of the sound according to the location of the sound source and the audience. As a result, the method proposed in this paper proposes an efficient way to synthesize the sound of bubble particles, which utilizes the velocity and position of the bubble particles projected in the lattice space, and synthesizes the sound of bubble particles based on the position relationship of the audience and the directionality of the sound.

NUMERICAL SOLUTION OF LAMINAR FLOW OVER SQUARE CYLINDER IN A CHANNEL AND EVALUATION OF LBM SIMULATION RESULTS (사각 실린더 주위의 2차원 층류 유동해석과 LBM 해석 결과의 평가)

  • Kim H.M.
    • Journal of computational fluids engineering
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    • v.10 no.2
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    • pp.30-37
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    • 2005
  • To evaluate LBM we performed the simulation of the unsteady two dimensional flow over a square cylinder in a channel in moderate Reynolds number range, $100\~500$ by using LBM and Fractional-Step method. Frist of all we compared LBM solution of Poiseuille flow applied Farout and periodic boundary conditions with the analytical solution to verify the applicability of the boundary conditions. For LBM simulation the calculation domain was formed by structured 500x100 grids. Prescribed maximum velocity and density inlet and Farout boundary conditions were imposed on the in-out boundaries. Bounceback boundary condition was applied to the channel and the cylinder waifs. The flow patterns and vortex shedding strouhal numbers were compared with previous research results. The flow patterns by LBM were in agreement with the flow pattern by fractional step method. Furthermore the strouhal number computed by LBM simulation result was more accurate than that of fractional step method through the comparison of the previous research results.

Unsteady Aerodynamic Characteristics of Floating Offshore Wind Turbine According to Wave Height and Wave Angular Frequency (해상용 부유식 풍력 발전기의 파고와 파주기에 따른 비정상 공력 특성 연구)

  • Jeon, Minu;Kim, Hogeon;Lee, Soogab
    • 한국신재생에너지학회:학술대회논문집
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    • 2010.11a
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    • pp.184.1-184.1
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    • 2010
  • Floating wind turbines have been suggested as a feasible solution for going further offshore into deeper waters. However, floating platforms cause additional unsteady motions induced by wind and wave conditions, so that it is difficult to predict annual energy output of wind turbines by using conventional power prediction method. That is because sectional inflow condition on a rotor plane is varied by unsteady motion of floating platforms. Therefore, aerodynamic simulation using Vortex Lattice Method(VLM) were used to investigate the influence of motion on the aerodynamic performance of a floating offshore wind turbine. Simulation with individual motion of offshore platform were compared to the case of onshore platform and carried out according to the wave height and the wave angular frequency.

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Analysis of optical splitters in photonic crystals (광자 크리스탈로 구성된 광 분배기의 특성 연구)

  • 윤지수;정교방
    • Korean Journal of Optics and Photonics
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    • v.13 no.1
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    • pp.27-31
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    • 2002
  • We design a 1$\times$4 optical splitter made of photonic crystal waveguides and analyze the properties of the optical splitter using the finite-difference time-domain method with perfectly-matched-layer absorbing boundaries. The photonic crystal is constructed from cylindrical rods in air on a square lattice. Our simulation results show that there are different transmission properties for four bend geometries and different incident-wave frequencies. The sum of the power transmission of the splitted light is over 93 percent at a certain geometry and frequency, and the incident power splits in the four arms with almost the same ratio.

Validation of Aero and Aero-Acoustics simulation for HAWT Model through LBM based technology

  • Senthooran, Sivapalan;Kandasamy, Satheesh;Balasubramanian, Ganapathi
    • Proceedings of the Korean Society for Noise and Vibration Engineering Conference
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    • 2010.05a
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    • pp.340-341
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    • 2010
  • A computational study to capture the flow around a floor mounted greenhouse shaped HAWT model was performed using the commercial software PowerFLOW 4.2b. The simulation kernel of this software is based on the numerical scheme known as the Lattice Boltzmann Method (LBM), combined with an RNG turbulence model. Simulations were performed at 60 and 140 km/h free stream air speeds. Selective results from these computational simulations are presented to show the capability of this numerical approach to predict the aerodynamics and aeroacoustics characteristics of the 3-D flow field around the HAWT model.

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Simulation on Surface Tracking Pattern using the Dielectric Breakdown Model

  • Kim, Jun-Won;Roh, Young-Su
    • Journal of Electrical Engineering and Technology
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    • v.6 no.3
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    • pp.391-396
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    • 2011
  • The tracking pattern formed on the dielectric surface due to a surface electrical discharge exhibits fractal structure. In order to quantitatively investigate the fractal characteristics of the surface tracking pattern, the dielectric breakdown model has been employed to numerically generate the surface tracking pattern. In dielectric breakdown model, the pattern growth is determined stochastically by a probability function depending on the local electric potential difference. For the computation of the electric potential for all points of the lattice, a two-dimensional discrete Laplace equation is solved by mean of the successive over-relaxation method combined to the Gauss-Seidel method. The box counting method has been used to calculate the fractal dimensions of the simulated patterns with various exponent $\eta$ and breakdown voltage $\phi_b$. As a result of the simulation, it is found that the fractal nature of the surface tracking pattern depends strongly on $\eta$ and $\phi_b$.

Development of the PRE-MARK and the Core Model for Kori Unit 1 Simulator (고리1호기 시뮬레이터 PRE-MARK 및 노심모델 개발)

  • 홍진혁
    • Proceedings of the Korea Society for Simulation Conference
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    • 2003.06a
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    • pp.101-105
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    • 2003
  • 본 논문은 고리 1호기 원자력발전소를 기준발전소로 하여 개발된 PRE-MARK 소개 및 PRE-MARK을 기반으로 개발된 노심모델의 결과를 제시하고자 하는 것을 주된 목적으로 하고 있다. 노심 모델개발에는 REMARK 모델 프로그램을 기반으로 개발된 PRE-MARK를 이용하였으며, PRE-MARK의 주요 특징으로는 노심모델 입력자료를 노심설계코드 및 Lattice 코드로부터 자동으로 생성하며여 GUI 기반으로 변경된 REMARK으로 입력하여 노심모델을 구동함과 동시에 실시간으로 중요 변수의 현재 값들을 그래프로 도시해줌으로 조율 (Tuning) 상수를 용이하게 결정할 수 있도록 하는 것이다. 또한 BOL 및 EOL에서 HFP 평형 Xenon조건에서의 제어봉 위치에 따른 제어봉가(Rod worth)를 고리 1호기 20주기 NDR (Nuclear Design Report)과 비교하고, 원자로정지 이후 BOL, MOL 및 EOL에서의 시간에 따른 Xenon의 반응도 영향을 비교함으로 개발된 모델의 건전성을 입증하였다.

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