• Title/Summary/Keyword: Multiscale Model

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Covalent Organic Frameworks for Extremely High Reversible $CO_2$ and $H_2$ Uptake Capacity : A Multiscale Simulation Approach (우수한 가역적 이산화탄소 및 수소 저장성능을 가지는 공유결합성 유기적 골격구조체에 관한 다중스케일 접근법을 이용한 연구)

  • Choi, Yoon Jeong;Choi, Jung Hoon;Choi, Kyung Min;Kang, Jeung Ku
    • 한국신재생에너지학회:학술대회논문집
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    • 2010.11a
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    • pp.113.2-113.2
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    • 2010
  • We report that the novel covalent organic frameworks (COFs) are capable of reversibly providing an extremely high uptake capacity of carbon dioxide and hydrogen at room temperature. These COFs are designed based on the multiscale simulations approach via the combination of ab initio calculations and force-field calculations. For this goal, we explore the adsorption sites of carbon dioxide and hydrogen on COFs, their porosity, as well as carbon dioxide adsorption isotherms. We identify the binding sites and energies of $CO_2$ on COFs using ab initio calculations and obtain the carbon dioxide adsorption isotherms using grand canonical ensemble Monte Carlo calculations. Moreover, the calculated adsorption isotherms are compared with the experimental values in order to build the reference model in describing the interactions between the $CO_2/H_2$ and the COFs and in predicting the $CO_2$ and $H_2$ adsorption isotherms of COFs. Finally, we design three new COFs, 2D COF-05, 3D COF-05 (ctn), and 3D COF-05 (bor), for the high capacity $CO_2/H_2$ and $H_2$ storage.

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Development of a Real-time Monitoring Device for Measuring Particulate Matter

  • Kim, Dae Seong;Cho, Young Kuk;Yoon, Young Hun
    • Particle and aerosol research
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    • v.10 no.1
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    • pp.1-8
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    • 2014
  • In this study, we have developed a real-time monitoring device for measuring $PM_{10/2.5/1}$ of ambient aerosol particles. The real-time PM (Particulate Matter) monitor was based on the light scattering method and had 16 channels in particle size. The laboratory and field tests were carried out to evaluate the performance of the PM monitor developed. Arizona Road Dust particles ranging from diameter of 0.1 to $20{\mu}m$ were generated as test particles in the laboratory test. The field test was carried out at the Seoul Meteorological Observatory. We can obtain the particle size and number concentration (particle size distribution) only from the real-time PM monitor developed. Therefore, the average density of aerosol particles was used to obtain the PM data from the particle size distribution. The $PM_{10/2.5/1}$ results of the PM monitor were compared with the data of the Grimm Dust Monitor (Model 1.108) and a beta ray gauge (Thermo Fisher Scientific). As a result, it was shown that the $PM_{10/2.5/1}$ results obtained by the real-time PM monitor agreed well with the data of the reference devices, and overall, the real-time PM monitor could be used as a PM monitoring device for real-time monitoring of the ambient particles.

Multiscale bending and free vibration analyses of functionally graded graphene platelet/ fiber composite beams

  • Garg, A.;Mukhopadhyay, T.;Chalak, H.D.;Belarbi, M.O.;Li, L.;Sahoo, R.
    • Steel and Composite Structures
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    • v.44 no.5
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    • pp.707-720
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    • 2022
  • In the present work, bending and free vibration analyses of multilayered functionally graded (FG) graphene platelet (GPL) and fiber-reinforced hybrid composite beams are carried out using the parabolic function based shear deformation theory. Parabolic variation of transverse shear stress across the thickness of beam and transverse shear stress-free conditions at top and bottom surfaces of the beam are considered, and the proposed formulation incorporates a transverse displacement field. The present theory works only with four unknowns and is computationally efficient. Hamilton's principle has been employed for deriving the governing equations. Analytical solutions are obtained for both the bending and free vibration problems in the present work considering different variations of GPLs and fibers distribution, namely, FG-X, FG-U, FG-Λ, and FG-O for beams having simply-supported boundary condition. First, the matrix is assumed to be strengthened using GPLs, and then the fibers are embedded. Multiscale modeling for material properties of functionally graded graphene platelet/fiber hybrid composites (FG-GPL/FHRC) is performed using Halpin-Tsai micromechanical model. The study reveals that the distributions of GPLs and fibers have significant impacts on the stresses, deflections, and natural frequencies of the beam. The number of layers and shape factors widely affect the behavior of FG-GPL-FHRC beams. The multilayered FG-GPL-FHRC beams turn out to be a good approximation to the FG beams without exhibiting the stress-channeling effects.

Coupled foot-shoe-ground interaction model to assess landing impact transfer characteristics to ground condition

  • Kim, S.H.;Cho, J.R.;Choi, J.H.;Ryu, S.H.;Jeong, W.B.
    • Interaction and multiscale mechanics
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    • v.5 no.1
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    • pp.75-90
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    • 2012
  • This paper investigates the effects of sports ground materials on the transfer characteristics of the landing impact force using a coupled foot-shoe-ground interaction model. The impact force resulting from the collision between the sports shoe and the ground is partially dissipated, but the remaining portion transfers to the human body via the lower extremity. However, since the landing impact force is strongly influenced by the sports ground material we consider four different sports grounds, asphalt, urethane, clay and wood. We use a fully coupled 3-D foot-shoe-ground interaction model and we construct the multi-layered composite ground models. Through the numerical simulation, the landing impact characteristics such as the ground reaction force (GRF), the acceleration transfer and the frequency response characteristics are investigated for four different sports grounds. It was found that the risk of injury, associated with the landing impact, was reduced as the ground material changes from asphalt to wood, from the fact that both the peak vertical acceleration and the central frequency monotonically decrease from asphalt to wood. As well, it was found that most of the impact acceleration and frequency was dissipated at the heel, then not much changed from the ankle to the knee.

Parameter estimation of four-parameter viscoelastic Burger model by inverse analysis: case studies of four oil-refineries

  • Dey, Arindam;Basudhar, Prabir Kr.
    • Interaction and multiscale mechanics
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    • v.5 no.3
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    • pp.211-228
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    • 2012
  • This paper reports the development of a generalized inverse analysis formulation for the parameter estimation of four-parameter Burger model. The analysis is carried out by formulating the problem as a mathematical programming formulation in terms of identification of the design vector, the objective function and the design constraints. Thereafter, the formulated constrained nonlinear multivariable problem is solved with the aid of fmincon: an in-built constrained optimization solver module available in MatLab. In order to gain experience, a synthetic case-study is considered wherein key issues such as the determination and setting up of variable bounds, global optimality of the solution and minimum number of data-points required for prediction of parameters is addressed. The results reveal that the developed technique is quite efficient in predicting the model parameters. The best result is obtained when the design variables are subjected to a lower bound without any upper bound. Global optimality of the solution is achieved using the developed technique. A minimum of 4-5 randomly selected data-points are required to achieve the optimal solution. The above technique has also been adopted for real-time settlement of four oil refineries with encouraging results.

A combined stochastic diffusion and mean-field model for grain growth

  • Zheng, Y.G.;Zhang, H.W.;Chen, Z.
    • Interaction and multiscale mechanics
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    • v.1 no.3
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    • pp.369-379
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    • 2008
  • A combined stochastic diffusion and mean-field model is developed for a systematic study of the grain growth in a pure single-phase polycrystalline material. A corresponding Fokker-Planck continuity equation is formulated, and the interplay/competition of stochastic and curvature-driven mechanisms is investigated. Finite difference results show that the stochastic diffusion coefficient has a strong effect on the growth of small grains in the early stage in both two-dimensional columnar and three-dimensional grain systems, and the corresponding growth exponents are ~0.33 and ~0.25, respectively. With the increase in grain size, the deterministic curvature-driven mechanism becomes dominant and the growth exponent is close to 0.5. The transition ranges between these two mechanisms are about 2-26 and 2-15 nm with boundary energy of 0.01-1 J $m^{-2}$ in two- and three-dimensional systems, respectively. The grain size distribution of a three-dimensional system changes dramatically with increasing time, while it changes a little in a two-dimensional system. The grain size distribution from the combined model is consistent with experimental data available.

Fatigue life prediction for radial truck tires using a global-local finite element method

  • Jeong, Kyoung Moon;Beom, Hyeon Gyu;Kim, Kee-Woon;Cho, Jin-Rae
    • Interaction and multiscale mechanics
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    • v.4 no.1
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    • pp.35-47
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    • 2011
  • A global-local finite element modeling technique is employed in this paper to predict the fatigue life of radial truck tires. This paper assumes that a flaw exists inside the tire, in the local model. The local model uses an FEM fracture analysis in conjunction with a global-local technique in ABAQUS. A 3D finite element local model calculates the energy release rate at the belt edge. Using the analysis of the local model, a study of the energy release rate is performed in the crack region and used to determine the crack growth rate analysis. The result considers how different driving conditions contribute to the detrimental effects of belt separation in truck tire failure. The calculation of the total mileage on four sizes of radial truck tires has performed on the belt edge separation. The effect of the change of belt width design on the fatigue lifetime of tire belt separation is discussed.

Assessing the Applicability of Sea Cliff Monitoring Using Multi-Camera and SfM Method (멀티 카메라와 SfM 기법을 활용한 해식애 모니터링 적용가능성 평가)

  • Yu, Jae Jin;Park, Hyun-Su;Kim, Dong Woo;Yoon, Jeong-Ho;Son, Seung-Woo
    • Journal of The Geomorphological Association of Korea
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    • v.25 no.1
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    • pp.67-80
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    • 2018
  • This study used aerial and terrestrial images to build a three-dimensional model of cliffs located in Pado beach using SfM (Structure from Motion) techniques. Using both images, the study purposed to reduce the shadow areas that were found when using only aerial images. Accuracy of the two campaigns was assessed by root mean square error, and monitored by M3C2 (Multiscale Model to Model Cloud Comparison) method. The result of the M3C2 in closed areas such as sea cave and notch did not express the landforms partly. However, eroded debris on sea cliffs were detected as eroded area by M3C2, as well as in captured pictures by multi-camera. The result of this study showed the applicability of multi-camera and SfM in monitoring changes of sea cliffs.

Meso-scale based parameter identification for 3D concrete plasticity model

  • Suljevic, Samir;Ibrahimbegovic, Adnan;Karavelic, Emir;Dolarevic, Samir
    • Coupled systems mechanics
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    • v.11 no.1
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    • pp.55-78
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    • 2022
  • The main aim of this paper is the identification of the model parameters for the constitutive model of concrete and concrete-like materials capable of representing full set of 3D failure mechanisms under various stress states. Identification procedure is performed taking into account multi-scale character of concrete as a structural material. In that sense, macro-scale model is used as a model on which the identification procedure is based, while multi-scale model which assume strong coupling between coarse and fine scale is used for numerical simulation of experimental results. Since concrete possess a few clearly distinguished phases in process of deformation until failure, macro-scale model contains practically all important ingredients to include both bulk dissipation and surface dissipation. On the other side, multi-scale model consisted of an assembly micro-scale elements perfectly fitted into macro-scale elements domain describes localized failure through the implementation of embedded strong discontinuity. This corresponds to surface dissipation in macro-scale model which is described by practically the same approach. Identification procedure is divided into three completely separate stages to utilize the fact that all material parameters of macro-scale model have clear physical interpretation. In this way, computational cost is significantly reduced as solving three simpler identification steps in a batch form is much more efficient than the dealing with the full-scale problem. Since complexity of identification procedure primarily depends on the choice of either experimental or numerical setup, several numerical examples capable of representing both homogeneous and heterogeneous stress state are performed to illustrate performance of the proposed methodology.

Experimental study of a modeled building frame supported by pile groups embedded in cohesionless soil

  • Ravi Kumar Reddy, C.;Gunneswara Rao, T.D.
    • Interaction and multiscale mechanics
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    • v.4 no.4
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    • pp.321-336
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    • 2011
  • This paper presents the results of static vertical load tests carried out on a model building frame supported by pile groups embedded in cohesionless soil (sand). The effect of soil interaction on displacements and rotation at the column base and also the shears and bending moments in the columns of the building frame were investigated. The experimental results have been compared with those obtained from the finite element analysis and conventional method of analysis. Soil nonlinearity in the lateral direction is characterized by the p-y curves and in the axial direction by nonlinear vertical springs along the length of the piles (${\tau}-z$ curves) at their tips (Q-z curves). The results reveal that the conventional method gives the shear force in the column by about 40-60%, the bending moment at the column top about 20-30% and at the column base about 75-100% more than those from the experimental results. The response of the frame from the experimental results is in good agreement with that obtained by the nonlinear finite element analysis.