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  • Open Access

    ARTICLE

    Temperature-dependent Thermodynamic Behaviors of Carbon Fullerene Molecules at Atmospheric Pressure

    Wen-Hwa Chen1,2, Chun-Hung Wu1, Hsien-Chie Cheng3,4,5

    CMC-Computers, Materials & Continua, Vol.25, No.3, pp. 195-214, 2011, DOI:10.3970/cmc.2011.025.195

    Abstract The study aims at investigating the linear and volumetric thermal expansion coefficients (CTEs) at temperature below the Debye temperature and phase transformation behaviors at atmospheric pressure of carbon fullerenes, i.e., C60, C70 and C80, through a modified Nosé-Hoover (NH) thermostat method incorporated with molecular dynamics (MD) simulation. The calculated results are compared with those obtained from the standard NH and "massive" NHC (MNHC) thermostats and also with the literature experimental and theoretical data. Results show that at temperature below the Debye temperature, the CTEs of the fullerene molecules would significantly decrease with a decreasing temperature and tend… More >

  • Open Access

    ARTICLE

    Local Buckling Prediction for Large Wind Turbine Blades

    W. Liu, X. Y. Su, Y. R. An, K. F. Huang1

    CMC-Computers, Materials & Continua, Vol.25, No.2, pp. 177-194, 2011, DOI:10.3970/cmc.2011.025.177

    Abstract Local buckling is a typical failure mode of large scale composite wind turbine blades. A procedure for predicting the onset and location of local buckling of composite wind turbine blades under aerodynamic loads is proposed in this paper. This procedure is distinct from its counterparts in adopting the pressure distributions obtained from Computational Fluid Dynamics (CFD) calculations as the loads. The finite element method is employed to investigate local buckling resistance of the composite blade. To address the mismatch between the unstructured CFD grids of the blade surface and the finite shell elements used during More >

  • Open Access

    ARTICLE

    A lattice Boltzmann-Based Study of Plasma Sprayed Particles Behaviours

    R. Djebali1, B. Pateyron2, M. ElGanaoui3

    CMC-Computers, Materials & Continua, Vol.25, No.2, pp. 159-176, 2011, DOI:10.3970/cmc.2011.025.159

    Abstract Axisymetric lattice Boltzmann (LB) model is developed to investigate the interaction of momentum and heat between plasma hot gas and Alumina powders. The plasma flow is simulated using a double population lattice Boltzmann model and the plasma-particles interaction is modeled based on a Lagrangian approach for the motion and heat transfer equations. The present results show that the LB method is an efficient and powerful tool to comprehend and explain the very high complexity of the plasma jet physics as well as it preserves effectively the computational cost. The present results for the centerline temperature More >

  • Open Access

    ARTICLE

    A Computational Inverse Technique to Determine the Dynamic Constitutive Model Parameters of Concrete

    R. Chen1, X. Han1,2, J. Liu1, W. Zhang1

    CMC-Computers, Materials & Continua, Vol.25, No.2, pp. 135-158, 2011, DOI:10.3970/cmc.2011.025.135

    Abstract In this paper, a computational inverse technique is presented to determine the constitutive parameters of concrete based on the penetration experiments. In this method, the parameter identification problem is formulated as an inverse problem, in which the parameters of the constitutive model can be characterized through minimizing error functions of the penetration depth measured in experiments and that computed by forward solver LS-DYNA. To reduce the time for forward calculation during the inverse procedure, radial basis function approximate model is used to replace the actual computational model. In order to improve the accuracy of approximation More >

  • Open Access

    ARTICLE

    A Lie-Group Adaptive Method to Identify the Radiative Coefficients in Parabolic Partial Differential Equations

    Chein-Shan Liu1, Chih-Wen Chang2

    CMC-Computers, Materials & Continua, Vol.25, No.2, pp. 107-134, 2011, DOI:10.3970/cmc.2011.025.107

    Abstract We consider two inverse problems for estimating radiative coefficients α(x) and α(x, y), respectively, in Tt(x, t) = Txx(x, t)-α(x)T(x, t), and Tt(x, y, t) = Txx(x, y, t) + Tyy(x, y, t)-α(x, y)T(x, y, t), where a are assumed to be continuous functions of space variables. A Lie-group adaptive method is developed, which can be used to find a at the spatially discretized points, where we only utilize the initial condition and boundary conditions, such as those for a typical direct problem. This point is quite different from other methods, which need the overspecified final time data. Three-fold advantages can be gained More >

  • Open Access

    ARTICLE

    Simulation Analysis and Experiment Study of Nanocutting with AFM Probe on the Surface of Sapphire Substrate by Using Three Dimensional Quasi-steady Molecular Statics Nanocutting Model

    Zone-Ching Lin1, Ying-Chih Hsu1

    CMC-Computers, Materials & Continua, Vol.25, No.1, pp. 75-106, 2011, DOI:10.3970/cmc.2011.025.075

    Abstract The three-dimensional quasi-steady molecular statics nanocutting model is used by this paper to carry out simulation analysis of nanocutting of sapphire in order to explore the effects of conical tools with different tip radii of probe and straight-line cutting at different cutting depths, on cutting force. Meanwhile, this paper uses a cutting tool of atomic force microscopy (AFM) with a probe tip similar to a semisphere to conduct nanocutting experiment of sapphire substrate. Furthermore, from the experimental results of nanocutting sapphire substrate, this paper innovatively proposes the theoretical model and equation that the specific down… More >

  • Open Access

    ARTICLE

    Experimental and Analytical Studies on Concrete Cylinders Wrapped with Fiber Reinforced Polymer

    Bhashya V.1, Ramesh G.1, Sundar Kumar S.1, Bharatkumar B. H.1, Krishnamoorthy T.S.1, Nagesh R Iyer.1

    CMC-Computers, Materials & Continua, Vol.25, No.1, pp. 47-74, 2011, DOI:10.3970/cmc.2011.025.047

    Abstract Fibre-reinforced polymers (FRPs) are being introduced into a wide variety of civil engineering applications. These materials have been found to be particularly attractive for applications involving the strengthening and rehabilitation of existing reinforced concrete structures. In this paper, experimental investigations and analytical studies on four series of the concrete cylinders wrapped with FRP are presented. First series consist of concrete cylinders wrapped with one layer carbon fiber reinforced polymer (CFRP), second series concrete cylinders wrapped with two layers CFRP, in third series, concrete cylinders were wrapped with one layer glass fiber reinforced polymer (GFRP) and… More >

  • Open Access

    ARTICLE

    Ab initio Molecular Dynamics of H2 Dissociative Adsorption on Graphene Surfaces

    Kentaro Doi1,2, Ikumi Onishi1, Satoyuki Kawano1,3

    CMES-Computer Modeling in Engineering & Sciences, Vol.77, No.2, pp. 113-136, 2011, DOI:10.3970/cmes.2011.077.113

    Abstract Hydrogen technologies are currently one of the most actively researched topics. A lot of researches have tied to enhance their energy conversion efficiencies. In the present study, numerical analyses have been carried out focusing on hydrogen-storage carbon materials which are expected to realize high gravimetric and volumetric capacities. In particular, dissociative adsorption processes of H2 molecules above graphene surfaces have been investigated by ab initio molecular dynamics. The present results indicate that a steric graphene surface plays an important role in enhancing the charge transfer which induces dissociation of H2 and adsorption of H atoms on the More >

  • Open Access

    ARTICLE

    Simulation of Reactive Fluid Flow in a Solid Rocket Motor Combustion-Chamber with/without Nozzle

    W. A. El-Askary1,2, S. A. Wilson2, A. Hegab2

    CMES-Computer Modeling in Engineering & Sciences, Vol.76, No.3&4, pp. 235-266, 2011, DOI:10.3970/cmes.2011.076.235

    Abstract In the present work, a complete simulation of reactive flow in the combustion chamber of a rocket motor equipped with convergent-divergent nozzle has been introduced. The model describes the combustion process inside the combustion chamber considering a steady premixed reactant gas injected through side porous walls of the combustion chamber. The products flow through a convergent-divergent nozzle with adiabatic impermeable walls. The reactants are treated as two-dimensional, multi-components, turbulent compressible flow. The local properties of the mixture are calculated and updated during the solution process. At the boundary of the combustion chamber, a constant mass More >

  • Open Access

    ARTICLE

    Elastic Wave Propagation in Periodic Cellular Structures

    B.Y. Tian1, B. Tie1, D. Aubry1, X.Y. Su2

    CMES-Computer Modeling in Engineering & Sciences, Vol.76, No.3&4, pp. 217-234, 2011, DOI:10.3970/cmes.2011.076.217

    Abstract The present work is devoted to a theoretical analysis and numerical modeling of elastic wave propagation firstly in a one-dimensional periodic elastic rod structure and then in two-dimensional periodic elastic beam structures by using Bloch wave theorem. The dispersion relation between Bloch wave vectors and eigen frequencies is obtained and its dependency upon the micro-structural characteristics of the periodic cellular structure is analyzed. Thanks to the Bloch wave transforms, only the primitive cell is considered theoretically or numerically and the phenomena of frequency band-gaps and the diffracted waves caused by the periodic cells are modeled More >

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