Table Of ContentMANUFACTURING
DESIGN MATERIALS
MANUFACTURING
DESIGN MATERIALS
Proceedings of the
2nd World Congress
on Integrated Computational
Materials Engineering (ICME)
Sponsored by
TMS (The Minerals, Metals & Materials Society)
Held
July 7-11, 2013 at Salt Lake Marriott Downtown at City Creek,
Salt Lake City, Utah
Edited by
Mei Li, Carelyn Campbell, Katsuyo Thornton,
Elizabeth Holm, and Peter Gumbsch
Editors
MeiLi Elizabeth Holm
Carelyn Campbell Peter Gumbsch
Katsuyo Thornton
ISBN 978-3-319-48585-0 ISBN 978-3-319-48194-4 (eBook)
DOI 10.1007/978-3-319-48194-4
Chemistry and Materials Science: Professional
Copyright © 2016 by The Minerals, Metals & Materials Society
Published by Springer International Publishers, Switzerland, 2016
Reprint of the original edition published by lohn Wiley & Sons, Inc., 2013, 978-1-11876-689-7
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TABLE OF CONTENTS
2nd World Congress on Integrated
Computational Materials Engineering
Preface ................................................................................................................ xi
Acknowledgements ........................................................................................... xiii
Conference Editors/Organizers ........................................................................... xv
ICME Success Stories and Applications
Application of Computational Thermodynamics and CALPHAD in
Magnesium Alloy Development ........................................................................... 3
A. Luo
Modelling Precipitation Kinetics during Aging of Al-Mg-Si Alloys.................... 9
Q. Du, and J. Friis
Modeling Processing-Property Relationships to Predict Final Aluminum
Coil Quality ........................................................................................................ 15
K. Karhausen, G. Laptyeva, and S. Neumann
Residual Stress Modeling in Aluminum Wrought Alloys .................................. 25
B. Xiao, Q. Wang, C.-C. Chang, and J. Rewald
ICME Approach to Corrosion Pit Growth Prediction ......................................... 31
K. Smith, L. Chen, R. Darling, T. Garosshen, M. Jaworowski,
S. Opalka, S. Tulyani, and G. Zafiris
Steel-Ab Initio: Quantum Mechanics Guided Design of New
Fe-Based Materials ............................................................................................. 37
U. Prahl, W. Bleck, and A. Saeed-Akbari
Microstructure Mediated Design of Material and Product.................................. 43
A. Sinha, J. Allen, J. Panchal, and F. Mistree
Virtual Prototyping of Lightweight Designs Made with Cold and Hot Formed
Tailored Solutions ............................................................................................... 49
E. Billur, H. Porzner, and T. Altan
vv
Process Optimization
Multiscale Model for Non-Metallic Inclusions/Steel Composite System Using
Data Science Enabled Structure-Property Linkages ........................................... 57
A. Gupta, A. Cecen, S. Goyal, A. Singh, and S. Kalidindi
A Multi-Scale, Multi-Physics Optimization Framework for Additively
Manufactured Structural Components ................................................................ 63
T. El-Wardany, M. Lynch, W. Gu, A. Hsu, M. Klecka, A. Nardi,
and D. Viens
Optimal Process Control through Feature-Based State Tracking Along
Process Chains .................................................................................................... 69
M. Senn, N. Link, and P. Gumbsch
Application of ICME Methods for the Development of Rapid
Manufacturing Technologies .............................................................................. 75
T. Maiwald-Immer, T. Göhler, A. Fischersworring-Bunk, C. Körner,
F. Osmanlic, and A. Bauereiß
Analytical Modeling and Performance Prediction of Remanufactured
Gearbox Components ......................................................................................... 81
R. Pulikollu, N. Bolander, S. Vijayakar, and M. Spies
Design Optimization of Transmission of Si/SiO and Ge/SiO Multilayer
2 2
Coatings .............................................................................................................. 87
K. Iqbal, J. Sha, and A. Maqsood
The Study on the Induction Heating System: The Establishment of Analytical
Model with Experimental Verification and the Phenomenological Study on the
Process from Simulation Perspective .................................................................. 91
T. Zhu, F. Li, X. Li, and Y. Rong
Modelling the Process Chain of Cold Rolled Dual Phase Steel for
Automotive Application ..................................................................................... 97
A. Ramazani, and U. Prahl
Geometric Analysis of Casting Components .................................................... 103
Z. Quan, Z. Gao, Q. Wang, Y. Sun, X. Chen, and Y. Wang
A Microstructure-Strength Calculation Model for Predicting Tensile
Strength of AlSi Mg Alloy Castings ................................................................. 109
7
Y. Shi, Q. Xu, R. Chen, B. Liu, Q. Wu, and H. Yang
vvii
Validation of High Strength Cast Al-Zn-Mg-Cu Aluminum for Use in
Manufacturing Process Design ......................................................................... 117
M. David, R. Foley, J. Griffin, and C. Monroe
The Simulation as Prediction Tool to Determine the Method of Riser
Calculation More Efficient ............................................................................... 123
L. Suarez, and N. Coello
Multi-Objective Optimization of Microstructure in Wrought
Magnesium Alloys ............................................................................................ 129
B. Radhakrishnan, S. Gorti, and S. Simunovic
A Computational Framework for Integrated Process Design of High
Performance Parts ............................................................................................. 135
K. Agarwal, and R. Shivpuri
Materials Data for ICME
Consideration of Ecosystem for ICME ............................................................. 143
W. Ren
Cross-Scale, Cross-Domain Model Validation Based on Generalized
Hidden Markov Model and Generalized Interval Bayes' Rule ......................... 149
Y. Wang, D. McDowell, and A. Tallman
Application of Statistical and Machine Learning Techniques for Correlating
Properties to Composition and Manufacturing Processes of Steels .................. 155
P. Deshpande, B. Gautham, A. Cecen, S. Kalidindi, A. Agrawal,
and A. Choudhary
Building Blocks for ICME
Towards an Integrative Simulation of Microstructural Response to Case
Hardening of Microalloyed Steels .................................................................... 163
P. Fayek, T. Petermann, and U. Prahl
Ductility Prediction for Complex Magnesium Alloy Castings Using Quality
Mapping ............................................................................................................ 169
J. Zheng, M. Li, J. Forsmark, J. Zindel, and J. Allison
vixii
Advanced Dilatometry and Calorimetry for the Validation of Materials
Mechanical and Transformation Models .......................................................... 177
M. Reich, B. Milkereit, M. Krawutschke, J. Kalich, C. Schick,
and O. Kessler
The 3D X-Ray Crystal Microscope: An Unprecedented Tool for ICME ......... 183
G. Ice, J. Budai, E. Specht, B. Larson, J. Pang, R. Barabash,
J. Tischler, and W. Liu
3D Hybrid Atomistic Modeling of β'' in Al-Mg-Si: Putting the Full
Coherency of a Needle Shaped Precipitate to the Test ..................................... 189
F. Ehlers, S. Dumoulin, and R. Holmestad
The Role of the CALPHAD Approach in ICME .............................................. 195
F. Zhang, W. Cao, S. Chen, C. Zhang, and J. Zhu
Simulations of Precipitate Microstructure Evolution during Heat Treatment .. 201
K. Wu, G. Sterner, Q. Chen, H-J. Jou, J. Jeppsson, J. Bratberg,
A. Engström, and P. Mason
Development of Gradient Cemented Carbides through ICME Strategy ........... 207
Y. Du, Y. Peng, W. Zhang, W. Chen, P. Zhou, W. Xie, K. Cheng,
L. Zhang, G. Wen, and S. Wang
Full-Field Multi-Scale Modelling of Sheet Metal Forming Taking the Evolution
of Texture and Plastic Anisotropy into Account ............................................... 213
P. Van Houtte, J. Gawad, P. Eyckens, A. Van Bael, G. Samaey,
and D. Roose
Integrating Quench Modeling into the ICME Workflow .................................. 219
A. Banka, J. Franklin, and W. Newsome
Modeling Crack Propagation in Polycrystalline Alloys Using a Variational
Multiscale Cohesive Method ............................................................................ 225
V. Sundararagahavan, and S. Sun
A Coupled Approach to Weld Pool, Phase and Residual Stress Modelling of
Laser Direct Metal Deposition (LDMD) Processes .......................................... 231
M. Vogel, M. Khan, J. Ibara-Medina, A. Pinkerton, N. N'Dri,
a n d M. Megahed
Prediction of the Uncertainty in the Response of Lightweight Structures
Consisting of Solid Foams ................................................................................ 237
J. Hohe, and C. Beckmann
vxii i
Building 3D Microstructure Database Using an Advanced Metallographic
Serial Sectioning Technique and Robust 3D Segmentation Tools ................... 243
U. Adiga, M. Gorantla, J. Scott, D. Banks, and Y-S. Choi
A Brief Review of Precipitation Hardening Models for Aluminum Alloys ..... 249
G. Guo, Q. Wang, G. Wang, and Y. Rong
Crystal Plasticity Finite Element Modeling of Single Crystal Niobium
Tensile Tests with Weighted Dynamic Hardening Rule ................................... 255
A. Mapar, T. Bieler, F. Pourboghrat, and C. Compton
Three Dimensional X-ray Diffraction Contrast Tomography Reconstruction of
Polycrystalline Strontium Titanate during Sintering and Electron Backscatter
Diffraction Validation ....................................................................................... 259
M. Syha, W. Rheinheimer, B. Loedermann, A. Graff, A. Trenkle,
M. Baeurer, D.Weygand, W. Ludwig, and P. Gumbsch
Towards the Interface Level Understanding of Internally Oxidized Metal-Oxide
Composites: Cu-Al O ...................................................................................... 265
2 3
Y. Jiang, G. Lan, and C. Xu
Dislocation Density Based Crystal Plasticity Finite Element Model of
Polycrystals with Grain Boundary Effect ......................................................... 271
Z. Leng, A. Alankar, D. Field, N. Allain-Bonasso, and F. Wagner
ICME Challenges and Education
Integrated Realization of Engineered Materials and Products: A Foundational
Problem ............................................................................................................. 279
J. Allen, F. Mistree, J. Panchal, B. Gautham, A. Singh, S. Reddy,
N. Kulkarni, and P. Kumar
ICME–A Mere Coupling of Models or a Discipline of Its Own? ..................... 285
M. Bambach, G. Schmitz, and U. Prahl
Knowledge Assisted Integrated Design of a Component and Its Manufacturing
Process .............................................................................................................. 291
B. Gautham, N. Kulkarni, D. Khan, P. Zagade, S. Reddy,
and R. Uppaluri
Author Index ..................................................................................................... 297
Subject Index .................................................................................................... 301
xixi
Preface
This is a collection of manuscripts presented at the 2nd World Congress on Integrated
Computational Materials Engineering, a specialty conference organized by The
Minerals, Metals & Materials Society (TMS) and the five conference organizers, and
held in Salt Lake City, Utah, USA, on July 7-11, 2013.
Integrated Computational Materials Engineering (ICME) has received international
attention as it has been proven to shorten product and process development time,
while lowering cost and improving outcome. Building on the great success of the
1st Congress on Integrated Computational Materials Engineering in 2011 and the
motivation of the Materials Genome Initiative (MGI) announced in June 2011, the 2nd
World Congress on ICME convened researchers, educators, and engineers to assess
the state-of-the-art ICME and determine paths to further the global advancement of
ICME. Over 200 authors and attendees from all over the world contributed to this
conference in the form of presentations, lively discussions, and papers presented
in this volume. The international advisory committee members representing 14
different countries actively participated and promoted the conference.
The specific topics highlighted during this conference included ICME Success
Stories and Applications with separate sessions on lightweighting, composites,
ferrous, and non-ferrous applications; Process Optimization; Materials Data for
ICME; Building Blocks for ICME with separate sessions on experimental tools, first
principles and atomistic tools, computational thermodynamic and kinetics, process
and performance modeling; and ICME Challenges and Education. The conference
consisted of both all-conference single sessions and parallel sessions and integrated 10
keynote presentations from international experts, 2 panel discussions, 83 contributed
presentations, and 70 poster presentations. From the two evening posters sessions,
outstanding posters were selected for awards, which were presented to the authors
at the conference dinner. The first panel discussion highlighted the need for the
materials data infrastructure and initial efforts to develop such an infrastructure. The
panel consisted of materials data experts from industry, academia, and government.
The conference ended with a closing panel of experts focusing the discussion on the
needed next steps forward to help ensure a broader and more global implementation
of ICME in the future.
The 45 papers presented in these proceedings are divided into five sections: (1) ICME
Success Stories and Applications; (2) Process Optimization; (3) Materials Data for
ICME; (4) Building Blocks of ICME; and (5) ICME Challenges and Education.
These manuscripts represent a cross section of the presentations and discussions
from this conference. It is our hope that the 2nd World Congress on ICME and these
proceedings will further the global implementation of ICME, broaden the variety
of applications to which ICME is applied, and ultimately help industry design and
produce new materials more efficiently and effectively.
xi
