Proceedings of the 1st World Congress on Integrated Computational Materials Engineering (ICME)

Headquartered in the United States but international in both its membership and activities, The Minerals, Metals & Materials Society (TMS) is a rare professional organization that encompasses the entire range of materials and engineering, from minerals processing and primary metals production to basic research and the advanced applications of materials.

Preface ix Acknowledgements xi Conference Editors/Organizer s xiii Modeling Processing-Microstructure Relationships Correlated Nucleation of Precipitates in Magnesium Alloy WE54 3 H. Liu, Y. Gao, Y. Wang, andJ. Nie From Processing to Properties: Through-Process Modeling of Aluminum Sheet Fabrication 9 G. Gottstein, and V. Monies Advancement in Characterization and Modeling of Boundary Migration during Recrystallization 19 D. Jensen, Y. Zhang, A. Godfrey, and N. Moelans Effect of Pulling Velocity on Dendrite Arm Spacing in Steady-State Directionally Solidified Transparent Organic Alloy by Numerical Simulation 27 Y. Shi, Q. Xu, B. Liu, and M. Gong More Efficient ICME through Materials Informatics and Process Modeling 35 B. Gautham, R. Kumar, S. Bothra, G. Mohapatra, N. Kulkarni, and K. Padmanabhan Multi-Attribut e Integrated Forming-Crush Simulation Optimization Using Internal State Variable Model 43 A. Najafi, M. Rais-Rohani, and Y. Hammi Multiscale Modeling of Polycrystalline Magnetostrictive Alloy Galfenol: Microstructura l Model 57 V. Sundararaghava Numerical Evaluation of Energy Transfer during Surface Mechanical Attrition Treatment 63 X. Zhang, J. Lu, and S. Shi Phase-Field Simulation and Experimental Study of Precipitates in an Al-Si-Mg Alloy 69 Z. Gao, H Liao, K Dong, and Q. Wang Towards a Virtual Platform for Materials Processing 75 G. Schmitz, and U. Prahl Integrated Modeling of Tundish and Continuous Caster to Meet Quality Requirements of Cast Steels 81 A. Kumar Singh, R. Pardeshi, and S. Goyal Modeling Microstructure-Property Relationships Microstructure-basde Description of the Deformation of Metals: Theory and Application 89 D. Helm, A. Butz, D. Raabe, and P. Gumbsch Large Scale Finite Element Computations Using Real Grain Microstructure s 99 H. Proudhon Modelling and Measurement of Plastic Deformation and Grain Rotation at the Grain-to-Grani Level 107 D. Gonzalez, A. King, J. Quinta da Fonseca, P. Withers, and!. Simonovski Multi-Time Scaling Image Based Crystal Plasticity FE Models Dwell Fatigue Initiation in Polycrystalline Ti Alloys 113 S. Ghosh, andM. Callas Virtual Mechanical Testing of Composites: From Materials to Components 121 J. LLorca, and C. Gonzalez Design of Multifunctional Material Structures Using Topology Optimization with Feature Control 129 J. Guest, and S. Ha Development of Neural Networks for the Prediction of the Interrelationshpi between Microstructur e and Properties of Ti Alloys 135 P. Collins, S. Koduri, D. Huber, B. Welk, and H. Fraser Characterizing Residual Stresses in Monolithic Silicon-Carbide through the Use of Finite Element Analysis 145 B. Munn, and K. Li Density Functional Theory Based Calculations of Site Occupancy in the Gamma Prime Ni3al Phase of Nickel Based Super Alloys 151 J. Du, M. Chaudhari, J. Tiley, and R. Banerjee Informatics for Mapping Engineering Data 159 K. Rajan, and S. Broderick Microstructura l Property Considerations in the Design of Stainless Steel Articles Case Hardened by Low-Temperatur e Carburization 165 J. Rubinski, S. Collins, and P. Williams Deformation Twin Induced by Multi-strain in Nanocrystalline Copper: Molecular Dynamic Simulation 171 K. Chen, S. Shi, andJ. Lu Nondestructive Evaluation Modeling as an Integrated Component oflCMSE 177 J. Blackshire, R. Ko, and M. Chen Numerical Simulation of Brake Discs of CRH3 High-Speed Trains Based on Ansys 183 L. Yu, Y. Jiang, S. Lu, K. Luo, and H. Ru Modeling and Simulation of Process-Structure-Propeyr tof Magnesium Alloy Casting 189 Z. Han, L. Huo, and B. Liu The Role of ICME in Graduate and Undergraduate Education, Information Infrastructure, and Success Stories Teaching Transport Phenomena through Spreadsheet Programming and Numerical Methods 197 J. McGuffin-Cawley History of ICME in the European Aluminium Industry 203 J. Hirsch, and K. Karhausen ICME Success at Timken -The Virtual Fatigue Life Test 211 P. Anderson, X. Ai, P. Glaws, andK. Sawamiphakdi Advances in Computational Tools for Virtual Casting of Aluminum Components 217 Q. Wang, P. Jones, Y. Wang, and D. Gerard Modelling the Process Chain of Microalloyed Case Hardening Steel for Energy Efficient High Temperature Carburising 223 U. Prahl, S. Konovalov, T. Henke, S. Benke, M. Bambach, and G. Schmitz Cyberinfrastructue rSupport for Integrated Computationla Materiasl Engineering 229 T. Haupt Stability of Fe-C Martensite-Effect of Zener-Ordering 235 R. Naraghi, and M. Selleby Unintended Consequences: How Qualification Constrains Innovation 241 C Brice What Barriers Prevent ICME from Becoming Part of the Designer's Toolbox? 247 P. Ret Author Index 253 Subject Index 255