J. Wang¹, D. C. C. Lam²

CMC-Computers, Materials & Continua, Vol.17, No.3, pp. 215-232, 2010, DOI:10.3970/cmc.2010.017.215

Abstract Selected elastic moduli of nanocomposites are higher than the elastic moduli of microcomposites. Molecular immobilization and crystallization at the interfaces had been proposed as potential causes, but studies suggested that these effects are minor and cannot be used to explain the magnitude observed in nanocomposites with >3nm particles. Alternately, molecular simulation of polymer deformation showed that rotation gradients can lead to additional molecular rotations and stiffen the matrix. The stiffening is characterized by the nanostiffening material parameter, l2. In this investigation, an analytical expression for nanostiffening in nanocomposites was developed using finite element analysis. The nanostiffening in nanocomposites was determined… More >

T.Y. Wu¹, W.C. Tsai², J.J. Lee²

CMC-Computers, Materials & Continua, Vol.17, No.3, pp. 175-214, 2010, DOI:10.3970/cmc.2010.017.175

Abstract The crushing of cellular materials is a highly nonlinear problem, for which geometrical, material, and contact/impact must be treated in one analysis. In order to develop a framework able to solve it efficiently and accurately, in this paper procedures for in-plane crushing analysis of cellular materials using vector form intrinsic finite element (VFIFE) is performed. A beam element of VFIFE is employed to handle large rotation and large deflection in the cell walls. An elastic-plastic material model with mixed hardening rule is adopted to account for material nonlinearity. In addition, an efficient contact/impact algorithm is designed to treat the complex… More >

Surya R. Kalidindi^1,2,3, Stephen R. Niezgoda¹, Giacomo L,i^1,1, Tony Fast¹

CMC-Computers, Materials & Continua, Vol.17, No.2, pp. 103-126, 2010, DOI:10.3970/cmc.2010.017.103

Abstract This paper presents a novel mathematical framework for building a comprehensive materials knowledge system (MKS) to extract, store and recall hierarchical structure-property-processing linkages for a broad range of material systems. This new framework relies heavily on the use of computationally efficient FFT (Fast Fourier Transforms)-based algorithms for data-mining local structure-response-structure evolution linkages from large numerical datasets produced by established modelling strategies for microscale phenomena. Another salient feature of this new framework is that it facilitates flow of high fidelity information in both directions between the constituent length scales, and thereby offers a new strategy for concurrent multi-scale modelling of materials… More >

Surkay D. Akbarov^1,2, Resat Kosker³, Yasemen Ucan³

CMC-Computers, Materials & Continua, Vol.17, No.2, pp. 77-102, 2010, DOI:10.3970/cmc.2010.017.077

Abstract In the framework of the piecewise homogeneous body model with the use of the three-dimensional geometrically non-linear exact equations of the theory of elasticity, the method for determination of the stress-strain state in the infinite body containing periodically located row of periodically curved fibers is developed. It is assumed that the midlines of the fibers are in the same plane. With respect to the location of the fibers according to each other the sinphase and antiphase curving cases are considered. Numerical results on the effect of the geometrical non-linearity to the values of the self balanced shear and normal stresses… More >

Qunfeng Liu¹, gping Shen²

CMC-Computers, Materials & Continua, Vol.17, No.1, pp. 59-76, 2010, DOI:10.3970/cmc.2010.017.059

Abstract Molecular Dynamics (MD) simulations have been performed using the EAM potential to investigate the deformation behaviors and mechanical properties of <100>/{100} gold nanowires with square cross-section at a certain strain rate under different temperatures ranging from 10 K to 700 K. It is found that <100>/{100} gold nanowires at high temperatures tend to form the extended stable nanobridges-Helical Multi-shell Structure (HMS), which is similar to the deformation behavior of <110> gold nanowires at room temperature reported in the previous experimental observations and simulations. The effect of temperature on the mechanical properties and deformation behaviors of gold nanowires was analyzed. The… More >

Taotao Hu¹, gping Shen^1,2

CMC-Computers, Materials & Continua, Vol.17, No.1, pp. 41-58, 2010, DOI:10.3970/cmc.2010.017.041

Abstract In this paper, an axisymmetric indentation model is set up to calculate the effects of the roughness of the thermally grown oxide (TGO) layer, which was modeled as a sinusoidal wave, on the indentation response of the thermal barrier coatings. It is found that the amplitude, wavelength, and thickness of the thermally grown oxide layer have obvious influences on the indentation response, while the effect of the indenter position can be neglected. In the top coating layer, residual stress mainly occurs below the indenter and around the nearest two peaks of the thermally grown oxide layer to the indenter. Only… More >

Chih-Wen Chang¹, Chein-Shan Liu²

CMC-Computers, Materials & Continua, Vol.17, No.1, pp. 19-40, 2010, DOI:10.3970/cmc.2010.017.019

Abstract In this study, we employ a semi-analytical approach to solve a two-dimensional advection-dispersion equation (ADE) for identifying the contamination problems. First, the Fourier series expansion technique is used to calculate the concentration field C(x, y, t) at any time t < T. Then, we ponder a direct regularization by adding an extra termaC(x, y, 0) on the final time data C(x, y, T), to reach a second-kind Fredholm integral equation. The termwise separable property of kernel function allows us obtaining a closed-form solution of the Fourier coefficients. A strategy to choose the regularization parameter is offered. The solver utilized in… More >

S. Patala¹, C.A. Schuh¹

CMC-Computers, Materials & Continua, Vol.17, No.1, pp. 1-18, 2010, DOI:10.3970/cmc.2010.017.001

Abstract Recent advances in microstructural characterization have made it possible to measure grain boundaries and their networks in full crystallographic detail. Statistical studies of the complete boundary space using full crystallographic parameters (misorientations and boundary plane inclinations) are limited because the topology of the parameter space is not understood (especially for homophase grain boundaries). This paper addresses some of the complexities associated with the group space of grain boundaries, and resolves the topology of the complete boundary space for systems of two-dimensional crystals. Although the space of homophase boundaries is complicated by the existence of a `no-boundary' singularity, i.e., no boundary… More >

Giacomo Landi¹, Surya R. Kalidindi²

CMC-Computers, Materials & Continua, Vol.16, No.3, pp. 273-294, 2010, DOI:10.3970/cmc.2010.016.273

Abstract In this paper, we present a computationally efficient multi-scale framework for predicting the local fields in the representative volume element of a multiphase material system subjected to thermo-mechanical loading conditions. This framework for localization relationships is a natural extension of our recent work on two-phase composites subjected to purely mechanical loading. In this novel approach, the localization relationships take on a simple structure expressed as a series sum, where each term in the series is a convolution product of local structure and the governing physics expressed in the form of influence coefficients. Another salient feature of this approach is its… More >

Zone-Ching Lin¹and Ren-Yuan Wang¹

CMC-Computers, Materials & Continua, Vol.16, No.3, pp. 247-272, 2010, DOI:10.3970/cmc.2010.016.247

Abstract The paper establishes a new three-dimensional quasi-steady molecular statics nanoscale abrasive cutting model to investigate the abrasive cutting behavior in the downpressing and abrasive cutting process of a workpiece in chemical mechanical polishing (CMP) process. The downpressing and abrasive cutting process is a continuous process. The abrasive cutting process is done after the single abrasive particle has downpressed and penetrated a workpiece to a certain depth of a workpiece. The paper analyzes the effects of the abrasive particles with different diameters on action force. It also analyzes the action force change of abrasive particles with different diameters on the projected… More >