Volume 731, Issue 1

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December 2002

Symposium W — Modeling and Numerical Simulation of Materials Behavior and Evolution

Issue Editors:

E. A. Olevsky,
V. Tikare,
A. Zavaliangos

49 articles in this issue

Large-Scale Molecular Dynamics Simulations of Interstitial Defect Diffusion in Silicon
David A. Richie
Jeongnim Kim
John W. Wilkins
OriginalPaper 01 January 2003 Article: 910
How Do Martensitic Twin Boundaries Move?
Graeme J. Ackland
Udomsilp Pinsook
OriginalPaper 01 January 2003 Article: 820
The Simulation of Copper Drift in SiO₂ during Bias Temperature Stress (BTS) Test
Jang-Yeon Kwon
Ki-Su Kim
Ki-Bum Kim
OriginalPaper 01 January 2003 Article: 817
Size Effect and Geometrical Effect of Polycrystals and Thin Film/Substrate System in Micro-indentation Test
Y. Wei
M. Zhao
S. Tang
OriginalPaper 01 January 2003 Article: 816
Modeling And Photoabsorption Study of YPd2-xRhxB2C Superconductors
L.-S. Hsu
Y. K. Wang
M.-D. Lan
OriginalPaper 01 January 2003 Article: 813
Numerical Simulations of Microstructural Evolution of Lamellar Alloys: Applications to Pb-Sn Solder
Rifa J. El-Khozondar
Vitcheslav S. Solomatov
Veena Tikare
OriginalPaper 01 January 2003 Article: 812
Model Compound Vulcanization And IGC Asprediction Tools In Carbon Black Effect On Vulcanization
E. Vidal-Escales
M. P. Diago
S. Borrós
OriginalPaper 01 January 2003 Article: 811
Recent Developments in Simulating Grain Growth with Monte Carlo Algorithms
Qiang Yu
Sven K Esche
OriginalPaper 01 January 2003 Article: 611
Large Scale Statistics for Computational Verification of Grain Growth Simulations with Experiments
Melik C. Demirel
Andrewp Kuprat
Anthony D. Rollett
OriginalPaper 01 January 2003 Article: 610
A Model for Comprehensive Studies of porosity in Mesoporous Low-K Dielectrics
Mihailp Petkov
OriginalPaper 01 January 2003 Article: 520
Simulation of polycrystalline Ceramics with Micro-Cracks
Jianwu Cao
Yoshihisa Sakaida
Hiroshi Kawamoto
OriginalPaper 01 January 2003 Article: 518
Computer Simulation Studies of Fracture in Vitreous Silica
Romulo Ochoa
Michael Arief
Joseph H. Simmons
OriginalPaper 01 January 2003 Article: 517
Kinetic Monte Carlo Simulations of Strain-Induced Nanopatterning on Hexagonal Surfaces
M. I. Larsson
B. Lee
B. M. Clemens
OriginalPaper 01 January 2003 Article: 314
Large- Scale ab initio Simulations of Fe-doped SrTiO₃perovskites
R. A. Evarestov
R. I. Eglitis
G. Borstel
OriginalPaper 01 January 2003 Article: 312
Modeling of Phonon Dispersion in a Semiconductor Quantum Dot Crystal
Olga L. Lazarenkova
Alexander A. Balandin
OriginalPaper 01 January 2003 Article: 104
Multiscale Modeling of Point Defects and Free Surfaces in Semi-infinite Solids
V. K. Tewary
OriginalPaper 01 January 2003 Article: 99
Molecular Dynamics Study of Commensurate-Incommensuratephases in Hexamethylenetetramine Suberate
Yuansheng Pan
David Brown
Gervais Chapuis
OriginalPaper 01 January 2003 Article: 88
Phase Separation in Alumina-Chromia
M. S. McIntosh
T. H. Sanders Jr.
J. M. Hampikian
OriginalPaper 01 January 2003 Article: 87
Three Dimensional Modeling of Anisotropic Stress Effects in Thermal Oxidation of Silicon
Xiaopeng Xu
Norbert Strecker
Victor Moroz
OriginalPaper 01 January 2003 Article: 85
Modeling and Numerical Simulations of Microdiffraction from Deformed Crystals
R. I. Barabash
G. E. Ice
F. J. Walker
OriginalPaper 01 January 2003 Article: 83
Fundamentalproperty of the Solid Equation of State Infered from Shock Wavesphysics
Francis Chaissé
Olivier Heuzé
OriginalPaper 01 January 2003 Article: 81
Multiplicative Noise in Microstructure Evolution
K. G. Wang
M. E. Glicksman
P. Crawford
OriginalPaper 01 January 2003 Article: 77
Modeling the Diffusion-Controlled Growth of Needle andplate-Shapedprecipitates
Z. Guo
W. Sha
OriginalPaper 01 January 2003 Article: 75
Dimension and Damage Control in Sintering of Multilayerpowder Composites
Eugene A. Olevsky
Andrey L. Maximenko
Veena Tikare
OriginalPaper 01 January 2003 Article: 74
Modeling Microstructural Evolution During Sintering In A Complexpowder Compact
Veena Tikare
Michael V. Braginsky
OriginalPaper 01 January 2003 Article: 73
A Multiparticle Simulation of powder Compaction Using Finite Element Discretization of Individualparticles
Antonios Zavaliangos
OriginalPaper 01 January 2003 Article: 71
Effects of Triple Line Tension on the Surface Topography of polycrystals
Jon L. Hilden
Alexander H. King
OriginalPaper 01 January 2003 Article: 67
Simulation of Microstructural Evolution During Thermomechanical Cycling inpb-Sn Solders
Michael Woodmansee
Veena Tikare
OriginalPaper 01 January 2003 Article: 64
Control of primaryparticle Size and the Onset of Aggregate Formation: The Effect of Energy Release in Nanoparticle Collision and Coalescenceprocesses
Karl E. J. Lehtinen
Michael R. Zachariah
OriginalPaper 01 January 2003 Article: 62
Base-Catayticproperties of Solid Silicon Imidonitrides
Peter Kroll
Dirk Mertens
OriginalPaper 01 January 2003 Article: 59
From Bifurcations to Chua’speriodic Table
Roberto Tonelli
Len O. Chua
Franco Meloni
OriginalPaper 01 January 2003 Article: 58
Micromagnetics Simulation of Asymmetricpseudo-Spin Valve Dots
N. Dao
C. A. Ross
S. L. Whittenburg
OriginalPaper 01 January 2003 Article: 57
Estimation of thephenomenological Effective Diffusivity in Nanocrystalline Materials
Irina V. Belova
Graeme E. Murch
OriginalPaper 01 January 2003 Article: 55
Time Dependence of the Segregation of Diffusing Solute in Nanocrystalline Materials
Irina V. Belova
Graeme E. Murch
OriginalPaper 01 January 2003 Article: 54
Theoretical and Experimental Investigation of Thermal Stability of HfO₂/Si and HfO₂/SiO₂ Interfaces
Chun-Li Liu
Matt Stoker
Philip J. Tobin
OriginalPaper 01 January 2003 Article: 52
Damage Mechanisms Of Filled Siloxanes Forpredictive Multiscale Modeling Of Aging Behavior
Bryan Balazs
Robert Maxwell
Rick Gee
OriginalPaper 01 January 2003 Article: 48
Multiscale Modeling of Wavepropagation: FDTD/MD Hybrid Method
Krishna Muralidharan
Pierre A. Deymier
Joseph H. Simmons
OriginalPaper 01 January 2003 Article: 47
Dynamics and Thermodynamics of a system with multiple length scales
Stefano Curtarolo
Gerbrand Ceder
OriginalPaper 01 January 2003 Article: 44
Direct Simulation Monte Carlo Calculation: Strategies for Using Complex Initial Conditions
Michael I. Zeifman
Barbara J. Garrison
Leonid V. Zhigilei
OriginalPaper 01 January 2003 Article: 38
Migration of Aluminum Atoms in the Transformation of γ- to θ-Alumina
Shu-Hui Cai
Karl Sohlberg
OriginalPaper 01 January 2003 Article: 36
Phase Transformations of Anatase TiO2 on Cation Intercalation from Firstprinciples Simulation.
Marina V. Koudriachova
Nicholas M. Harrison
Simon W. de Leeuw
OriginalPaper 01 January 2003 Article: 35
A DFT-Study of Structure andproperties of Amorphous SiCN
Peter Kroll
OriginalPaper 01 January 2003 Article: 32
Non-Local Elasticity Kernels Extracted from Atomistic Simulations
R. C. Picu
OriginalPaper 01 January 2003 Article: 27
The Virial Stress Is Not a Measure of Mechanical Stress
Min Zhou
OriginalPaper 01 January 2003 Article: 26
Further Investigation and Application of theprinciple of Correspondence Between Elastic andpiezoelectricproblems
Edgar Karapetian
Larissa Gorbatikh
OriginalPaper 01 January 2003 Article: 24
Stochastic Dislocation Dynamics under Creep Conditions in Metals
Masato Hiratani
Hussein M. Zbib
OriginalPaper 01 January 2003 Article: 17
Theoretical Investigation of Thermal Conductivity in Wurtzite GaN
Dmitri Kotchetkov
Jie Zou
Alexander A. Balandin
OriginalPaper 01 January 2003 Article: 17
Simulations of Dislocation Dynamics in Aluminum Interconnects
Lucia Nicola
Erik Van der Giessen
Alan Needleman
OriginalPaper 01 January 2003 Article: 15
<100> Dislocation Loop Formation and Characterization in Ferritic Materials: Comparison between Experiments and Modeling
Jaime Marian
Brian D. Wirth
J. Manuel Perlado
OriginalPaper 01 January 2003 Article: 14

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