• Title/Summary/Keyword: multiscale simulation

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Molecular dynamics simulation of bulk silicon under strain

  • Zhao, H.;Aluru, N.R.
    • Interaction and multiscale mechanics
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    • v.1 no.2
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    • pp.303-315
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    • 2008
  • In this paper, thermodynamical properties of crystalline silicon under strain are calculated using classical molecular dynamics (MD) simulations based on the Tersoff interatomic potential. The Helmholtz free energy of the silicon crystal under strain is calculated by using the ensemble method developed by Frenkel and Ladd (1984). To account for quantum corrections under strain in the classical MD simulations, we propose an approach where the quantum corrections to the internal energy and the Helmholtz free energy are obtained by using the corresponding energy deviation between the classical and quantum harmonic oscillators. We calculate the variation of thermodynamic properties with temperature and strain and compare them with results obtained by using the quasi-harmonic model in the reciprocal space.

A Simulation of High Ozone Episode in Downwind Area of Seoul Metropolitan Using CMAQ Model (CMAQ을 이용한 수도권 풍하지역의 고농도 오존 현상 모사)

  • Lee, Chong Bum;Song, Eun Young
    • Journal of Environmental Impact Assessment
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    • v.15 no.3
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    • pp.193-206
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    • 2006
  • Recently, high ozone episode occurred frequently in Korea. Moreover ozone episode occurred not only in the city but also in background area where local anthropogenic sources are not important. It analyzed frequency exceeding 100ppb ozone at air quality monitoring stations in Seoul and rural area during 1995-2004. This paper reports on the use of the Community Multiscale Air Quality (CMAQ) modelling system to predict hourly ozone levels. Domain resolutions of 30km, 10km, 3.333km (innermost) have been employed for this study. Summer periods in June 2004 have been simulated and the predicted results have been compared to data for metropolitan and rural air quality monitoring stations. The model performance has been evaluated with measured data through a range of statistical measures. Although, the CMAQ model reproduces the ozone temporal spatial trends it was not able to simulate the peak magnitudes consistently.

Influence of grain interaction on lattice strain evolution in two-phase polycrystals

  • Han, Tong-Seok
    • Interaction and multiscale mechanics
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    • v.4 no.2
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    • pp.155-164
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    • 2011
  • The lattice strain evolution within polycrystalline solids is influenced by the crystal orientation and grain interaction. For multi-phase polycrystals, due to potential large differences in properties of each phase, lattice strains are even more strongly influenced by grain interaction compared with single phase polycrystals. In this research, the effects of the grain interaction and crystal orientation on the lattice strain evolution in a two-phase polycrystals are investigated. Duplex steel of austenite and ferrite phases with equal volume fraction is selected for the analysis, of which grain arrangement sensitivity is confirmed in the literature through both experiment and simulation (Hedstr$\ddot{o}$m et al. 2010). Analysis on the grain interaction is performed using the results obtained from the finite element calculation based on the model of restricted slip within crystallographic planes. The dependence of lattice strain on grain interactions as well as crystal orientation is confirmed and motivated the need for more in-depth analysis.

Reproducing kernel based evaluation of incompatibility tensor in field theory of plasticity

  • Aoyagi, Y.;Hasebe, T.;Guan, P.C.;Chen, J.S.
    • Interaction and multiscale mechanics
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    • v.1 no.4
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    • pp.423-435
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    • 2008
  • This paper employs the reproducing kernel (RK) approximation for evaluation of field theory-based incompatibility tensor in a polycrystalline plasticity simulation. The modulation patterns, which is interpreted as mimicking geometrical-type dislocation substructures, are obtained based on the proposed method. Comparisons are made using FEM and RK based approximation methods among different support sizes and other evaluation conditions of the strain gradients. It is demonstrated that the evolution of the modulation patterns needs to be accurately calculated at each time step to yield a correct physical interpretation. The effect of the higher order strain derivative processing zone on the predicted modulation patterns is also discussed.

Effect of road surface roughness on the response of a moving vehicle for identification of bridge frequencies

  • Yang, Y.B.;Li, Y.C.;Chang, K.C.
    • Interaction and multiscale mechanics
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    • v.5 no.4
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    • pp.347-368
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    • 2012
  • Measuring the bridge frequencies indirectly from an instrumented test vehicle is a potentially powerful technique for its mobility and economy, compared with the conventional direct technique that requires vibration sensors to be installed on the bridge. However, road surface roughness may pollute the vehicle spectrum and render the bridge frequencies unidentifiable. The objective of this paper is to study such an effect. First, a numerical simulation is conducted using the vehicle-bridge interaction element to demonstrate how the surface roughness affects the vehicle response. Then, an approximate theory in closed form is presented, for physically interpreting the role and range of influence of surface roughness on the identification of bridge frequencies. The latter is then expanded to include the action of an accompanying vehicle. Finally, measures are proposed for reducing the roughness effect, while enhancing the identifiability of bridge frequencies from the passing vehicle response.

Vibration analysis of CFST tied-arch bridge due to moving vehicles

  • Yang, Jian-Rong;Li, Jian-Zhong;Chen, Yong-Hong
    • Interaction and multiscale mechanics
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    • v.3 no.4
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    • pp.389-403
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    • 2010
  • Based on the Model Coupled Method (MCM), a case study has been carried out on a Concrete-Filled Steel Tubular (CFST) tied arch bridge to investigate the vibration problem. The mathematical model assumed a finite element representation of the bridge together with beam, shell, and link elements, and the vehicle simulation employed a three dimensional linear vehicle model with seven independent degrees-of-freedom. A well-known power spectral density of road pavement profiles defined the road surface roughness for Perfect, Good and Poor roads respectively. In virtue of a home-code program, the dynamic interaction between the bridge and vehicle model was simulated, and the dynamic amplification factors were computed for displacement and internal force. The impact effects of the vehicle on different bridge members and the influencing factors were studied. Meanwhile the acceleration responses of some of the components were analyzed in the frequency domain. From the results some valuable conclusions have been drawn.

Design and simulation of resonance based DC current sensor

  • Santhosh Kumar, B.V.M.P.;Suresh, K.;Varun Kumar, U.;Uma, G.;Umapathy, M.
    • Interaction and multiscale mechanics
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    • v.3 no.3
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    • pp.257-266
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    • 2010
  • A novel resonance based proximity DC current sensor is proposed. The sensor consists of a piezo sensed and actuated cantilever beam with a permanent magnet mounted at its free end. When the sensor is placed in proximity to a wire carrying DC current, resonant frequency of the beam changes with change in current. This change in resonant frequency is used to determine the current through the wire. The structure is simulated in micro and meso scale using COMSOL Multi physics software and the sensor is found to be linear with good sensitivity.

Signal Reconstruction by Synchrosqueezed Wavelet Transform

  • Park, Minsu;Oh, Hee-Seok;Kim, Donghoh
    • Communications for Statistical Applications and Methods
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    • v.22 no.2
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    • pp.159-172
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    • 2015
  • This paper considers the problem of reconstructing an underlying signal from noisy data. This paper presents a reconstruction method based on synchrosqueezed wavelet transform recently developed for multiscale representation. Synchrosqueezed wavelet transform based on continuous wavelet transform is efficient to estimate the instantaneous frequency of each component that consist of a signal and to reconstruct components. However, an objective selection method for the optimal number of intrinsic mode type functions is required. The proposed method is obtained by coupling the synchrosqueezed wavelet transform with cross-validation scheme. Simulation studies and musical instrument sounds are used to compare the empirical performance of the proposed method with existing methods.

Thermomechanical Local QC Analysis of Nanoscale Structure Considering Surface Effect (표면효과를 고려한 나노 사이즈 구조물의 local QC 열탄성 해석)

  • Yoo, Su-Young;Rhee, Seung-Yun;Cho, Maeng-Hyo
    • Proceedings of the Computational Structural Engineering Institute Conference
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    • 2007.04a
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    • pp.415-420
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    • 2007
  • In analyzing the nano-scale behavior of nano devices or materials, QC method is efficient because it does not treat all the atoms. But for more accurate analysis in QC method, it is important to consider temperature and surface effects. In finite temperature, free energy is considered instead of potential energy. Because the surface area to volume ratio increases as the length scale of a body decreases, the surface effects are more dominant. In this paper, temperature related Cauchy-Born rule and surface Cauchy-Born rule are proposed to configurate the strain energy density. This method is applied to small and homogeneous deformation in two dimensional problem using finite element simulation.

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Multi-type sensor placement design for damage detection

  • Li, Y.Q.;Zhou, M.S.;Xiang, Z.H.;Cen, Z.Z.
    • Interaction and multiscale mechanics
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    • v.1 no.3
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    • pp.357-368
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    • 2008
  • The result of damage detection from on-site measurements is commonly polluted by unavoidable measurement noises. It is widely recognized that this side influence could be reduced to some extent if the sensor placement was properly designed. Although many methods have been proposed to find the optimal number and location of mono-type sensors, the optimal layout of multi-type sensors need further investigation, because a network of heterogeneous sensors is commonly used in engineering. In this paper, a new criterion of the optimal placement for different types of sensors is proposed. A corresponding heuristic is developed to search for good results. In addition, Monte Carlo simulation is suggested to design a robust damage detection system which contains certain redundancies. The validity of these methods is illustrated by two bridge examples.