Publications
M. I Mendelev and D. J. Srolovitz, "A Regular Solution Model for Impurity Drag on a Migrating Grain Boundary", submitted to Acta Materialia.
D. J. Srolovitz and S. H. Davis, "Do Stresses Modify Wetting Angles?", Acta Materialia", submitted 7/15/00.
I. V. Apykhtina, B. S. Bokstein, A. S. Ostrovskii, A. L. Peteline, A. O. Rodine and D. J. Srolovitz, "Grain Boundary Wetting: Diffusion or Nondiffusion Mechanism", Diffusion and Defects Forum, submitted 7/00/00.
David J. Srolovitz and Monnesh Upmanyu, "Anisotropic Grain Boundary Properties for Modeling Grain Growth Phenomena," JFCC 2000 Workshop, in press (2000).
D. J. Srolovitz, M. I. Mendelev, M. Upmanyu, G. Gottstein, D. A. Molodov and L. S. Shvindlerman, "Grain Boundary Mobility in Metallic Alloys: Recent Simulations and Experiments ", in 21th Risĝ International Symposium on Materials Science: Recrystallization - Fundamental aspects and relations to deformation microstructure, in press (2000).
M. I. Mendelev, D. J. Srolovitz and W. E, "Grain Boundary Migration in the Presence of Diffusing Impurities: Simulations and Analytical Model", submitted to Philosophical Magazine A, 6/00.
S. M. Allameh, R. W. Hayes, M. Li, E. Loria, D. J. Srolovitz and W. O. Soboyejo, "Microstructure and Mechanical Properties of b Solid Solution Niobium-Based Alloy," submitted to Materials Science & Eng. A, 5/00.
M. A. Miodownik, P. Smereka, D. J. Srolovitz and E. A. Holm, "Scaling of Dislocation Cell Structures: Diffusion in Orientation Space", Proc. Roy. Soc. (Lond). 5/00
L. E. Shilkrot, D. J. Srolovitz and J. Tersoff, "Morphology Evolution During the Growth of Strained Layer Superlattices", Physical Review B, in press.
L. Dong, D. J. Srolovitz, G. S. Was, Q. Zhao and A. D. Rollett, "Combined Out-of-Plane and In-Plane Texture Control in Thin Films using Ion Beam Assisted Deposition", submitted to Journal of Materials Research, 3/8/00.
M. I. Mendelev and D. J. Srolovitz, "Kink Model for Extended Defect Migration: Theory and Simulation", Acta Materialia, in press.
R. C. Cammarata, T. M. Trimble and D. J. Srolovitz, "Surface Stress Model for Intrinsic Stress in Thin Films", Journal of Materials Research, in press.
L. E. Shilkrot, D. J. Srolovitz and J. Tersoff, "Dynamically Stable Growth of Strained-Layer Superlattices", Appl. Phys. Lett. 77 [2], 304-306 (2000).
Full Text:[HTML PDF]Y. Wang, D. J. Srolovitz, J. M. Rickman and R. LeSar, "Dislocation Motion in the Presence of Diffusing Solute: A Computer Simulation Study"", Acta Materialia, 48, 2163 (2000).
L. Yang, D. J. Srolovitz and A. F. Yee, "Molecular Dynamics Study of Uniaxial Deformation of an Amorphous Model Polymer: 2. Microscopic Aspects", Macromolecules, submitted 12/27/97.
L. Yang, D. J. Srolovitz and A. F. Yee, "Molecular Dynamics Study of Uniaxial Deformation of an Amorphous Model Polymer: 1. Macroscopic Aspects", Macromolecules, submitted 12/27/97.
Paritosh, D. J. Srolovitz, C. C. Battaile, X. Li and J. E. Butler, "Simulation of Faceted Film Growth in 2-D: Microstructure, Morphology and Texture," Acta Materialia 47 [7], 2269 (1999).
L. Yang, D. J. Srolovitz and A. F. Yee, "Molecular Dynamics Study of Isobaric and Isochoric Glass Transitions in a Model Amorphous Polymer", Journal of Chemical Physics 110 [14], 7058-7069 (1999).
Full Text:[HTML PDF]L. Dong and D. J. Srolovitz, "Mechanism of Texture Development in Ion Beam Assisted Deposition", Applied Physics Letter 75 [4], 584-586 (1999).
Full Text:[HTML PDF]M. Upmanyu, D. J. Srolovitz, L. S. Shvindlerman, and G. Gottstein, "Triple Junction Mobility: A Molecular Dynamics Study", Interface Science 7 [4], 307-319 (1999).
M. Upmanyu, D. J. Srolovitz, L. S. Shvindlerman, and G. Gottstein, "Misorientation Dependence of Intrinsic Grain Boundary Mobility: Simulation and Experiment", Acta Materialia 47 [14], 3901-3914 (1999).
C. C. Battaile, D. J. Srolovitz, I. I. Oleinik, D. G. Pettifor, A. P. Sutton, S. J. Harris and J. E. Butler, "Etching Effects during the Chemical Vapor Deposition of (100) Diamond," Journal of Chemical Physics 111 [9], 4291-9 (1999).
Full Text:[HTML PDF]C. C. Battaile, D. J. Srolovitz and J. E. Butler, "Point Defect Incorporation During Diamond Chemical Vapor Deposition," Journal of Materials Research, 14 [8], 3439-3446 (1999).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Defect Model of Twinning in Ferroelectrics," Acta Materialia 47 [4], 1325-1336 (1999).
J. R. Smith, J. E. Raynolds, E. R. Roddick, and D. J. Srolovitz, "Impurity Effects on Adhesion at an Interface between NiAl and Mo," Acta Materialia 47 [11], 3281-3289 (1999).
I. I. Oleinik, D. G. Pettifor, A. P. Sutton, C. C. Battaile, D. J. Srolovitz and J. E. Butler, "Surface Chemistry of CVD Diamond: Linking the Nanoscale and Mesoscale Modelling Hierarchies," in "Multiscale Modelling of Materials," eds. Diaz de la Rubia, Kaxiras, Bulatov, Ghoniem, Phillips, Materials Research Society Symposium 538, 275-284 (1999)
M. Upmanyu, D. J. Srolovitz, G. Gottstein and L. Shvindlerman, "Vacancy Generation During Grain Boundary Migration," Interface Science 6 [4], 287-298 (1998).
L. Dong and D. J. Srolovitz, "Texture Development Mechanisms in Ion Beam Assisted Deposition," Journal of Applied Physics 84 [9], 5261-5269 (1998).
Full Text: [ PDF]C. Battaile, D. J. Srolovitz and J. E. Butler, "Atomic-Scale Simulations of Chemical Vapor Deposition on Flat and Vicinal Diamond Substrates," Journal of Crystal Growth 194, 353-368 (1998).
Full Text: [ PDF]D. J. Srolovitz, N. Sridhar, J. P. Hirth and J. W. Cahn, "Shape of Hollow Dislocation Cores: Anisotropic Surface Energy and Elastic Effects", Scripta Materialia 39 [4-5], .379-387 (1998).
J. Schnitker and D. J. Srolovitz, "Misfit Effects in Adhesion Calculations," Modelling and Simulation in Materials Science and Engineering 6, 153-164 (1998).
E. A. Holm, N. Zacharopoulos, and D. J. Srolovitz, "Nonuniform and Directional Grain Growth Caused by Grain Boundary Mobility Variations", Acta Materialia 46 [3], 953-964 (1998).
L. E. Shilkrot and D. J. Srolovitz, "Elastic Analysis of Finite Stiffness Bimaterial Interfaces: Application to Dislocation-Interface Interactions", Acta Materialia 46 [9], 3063-3075 (1998).
L. Dong, J. Schnitker, R. W. Smith and D. J. Srolovitz, "Stress Relaxation and Misfit Dislocation in Heteroepitaxial Film Growth: A Molecular Dynamics Simulation Study," J. Applied Physics 83 [1], 217-227 (1998).
Full Text: [ PDF]M. Upmanyu, R. W. Smith and D. J. Srolovitz, "Atomistic Simulation of Curvature Driven Grain Boundary Migration", Interface Science 6, 41-58 (1998).
C. Battaile, D. J. Srolovitz and J. E. Butler, "3-D Atomistic Kinetic Monte Carlo Simulations of Point Defect Incorporation During CVD Diamond Film Growth," Materials Research Society Symposium Proceedings 441, 509-514 (1997).
G. S. Was, D. J. Srolovitz, Z. Ma and D. Liang, "Microstructure Control for Thin Film Metallization", Mat. Res. Soc. Symp. Proc.441, 311-322 (1997)
N. Sridhar, J.M. Rickman and D. J. Srolovitz, "Microstructural Stability Of Stressed Lamellar Eutectics", Thermodynamics and Kinetics of Phase Transformations (Mater. Res. Soc., Pittsburgh, PA, 1997), pp. 445-450.
J. R. Smith, T. Hong, J. E. Raynolds, E. Roddick, and D. J. Srolovitz, "Universal Behavior in Adhesion of Some High Temperature Materials", Processing and Design Issues in High Temperature Materials, ed. N. S. Stoloff and R. H. Jones, (TMS, Warrendale, PA, 1997), p. 37-48.
D. J. Srolovitz, D. S. Dandy, J. E. Butler, C. C. Battaile and Paritosh, "Integrated Multi-Scale Modeling of Diamond Chemical Vapor Deposition", JOM - J. Min. Met. Mat. S. 49 [9], 42-47 (1997).
C. C. Battaile, D. J. Srolovitz and J. E. Butler, "Molecular View of Diamond CVD Growth", Journal of Electronic Materials 26 [9], 960-965 (1997).
C. C. Battaile, D. J. Srolovitz and J. E. Butler, " Morphologies of Diamond Films from Atomistic Simulations of Chemical Vapor Deposition", Diamond and Related Materials 6 [9], 1198-1206 (1997).
C. C. Battaile, D. J. Srolovitz and J. E. Butler, "A Kinetic Monte Carol Method for the Atomic Scale Simulation of Chemical Vapor Deposition: Application to Diamond", Journal of Applied Physics 82 [12] 6293-6300 (1997).
Full Text: [ PDF]L. Yang, D. J. Srolovitz, and A. F. Yee, "Extended Ensemble Molecular Dynamics Method for Constant Strain Rate Uniaxial Deformation of Polymer Systems", Journal of Chemical Physics 107 [11], 4396-4407 (1997).
Full Text: [ PDF]L. E. Shilkrot and D. J. Srolovitz, "Anisotropic Elastic Analysis And Atomistic Simulation Of Adatom-Adatom Interactions On Solid Surfaces", Journal of the Mechanics and Physics of Solids 45 [11/12], 1861-1873 (1997).
N. Zacharopoulos, D. J. Srolovitz, and R. A. LeSar, "Dynamic Simulation of Dislocation Microstructure in Mode III Cracking", Acta Materialia 45 [9], 3745-3763 (1997).
L. Shilkrot and D. J. Srolovitz, "Adatom-Step Interactions: Atomistic Simulations And Elastic Models", Physical Review B 55 [7], 4737-4744 (1997).
Full Text: [ PDF]N.Sridhar, J.M.Rickman, and D. J.Srolovitz, "Multilayer Film Stability", Journal of Applied Physics 82 [10], 4852-4859 (1997).
Full Text: [ PDF]N.Sridhar, J.M.Rickman, and D. J.Srolovitz, "Microstructural Stability Of Stressed Lamellar and Fiber Composites", Acta Materialia 45 [7], 2715-2733 (1997).
R. W. Smith and D. J. Srolovitz, "Void and Dislocation Microstructure Development in Heteroepitaxial Film Growth", Mat. Res. Soc. Symp. Proc. 399, 371-376 (1996).
R. W. Smith and D. J. Srolovitz, "Computer Simulation of Impact Induced Fracture and Fragmentation in Brittle Solids", in Shock Compression '95 (AIP, New York, 1996), p.171-174.
J. E. Raynolds, J. R. Smith, G.-L. Zhao, and D. J. Srolovitz, "NiAl-Cr Adhesion", Materials Research Society Proceedings 409, 177-182 (1996).
E. A. Holm, A. D. Rollett, and D. J. Srolovitz, "Mesoscopic Simulations of Recrystallization", Computer Simulation in Materials Sciences" in Computer Simulation in Materials Science, ed. H.O. Kirchner, et al. (Kluwer, Netherlands, 1996), pg. 373-389.
D. J. Srolovitz, W. Yang, M.G. Goldiner, "Thermodynamics of Hole and Hillock Growth in Thin Films," Materials Research Society Symposium Proceedings 403, 3-13 (1996).
N. Zacharopoulos, D. J. Srolovitz, R.A. LeSar and P.M. Anderson, "Dynamic Simulation of Crack Propagation with Dislocation Emission and Migration", Materials Research Society Symposium 409, 115-120 (1996).
L. E. Shilkrot And D. J. Srolovitz, "Atomistic Simulation And Elastic Theory Of The Elasticity Of Surface Steps", Materials Research Society Symposium 399, 505-510 (1996).
R. W. Smith, F. Ying, D. J. Srolovitz, "Microstructure And Stress Evolution During Thin Film Deposition", Materials Research Society Symposium, 1996.
R. W. Smith, F. Ying, D. J. Srolovitz, "Growth And Texture Of Polycrystalline Thin Films", Materials Research Society Symposium, Polycrystalline Thin Films: Structure, Texture, Properties, and Applications II. Symposium. Mater. Res. Soc., (Pittsburgh, PA, 1996), pp.39-44.
F. Ying, R. W. Smith and D. J. Srolovitz, "Texture Formation by Preferential Sputtering and Shadowing during Film Growth", Appl. Phys. Letters 68 [20], 3007-3009 (1996).
Full Text: [ PDF]Liang Dong, Richard W. Smith and D. J. Srolovitz, "A Two Dimensional Molecular Dynamics Simulation of Thin Film Growth by Oblique Deposition", Journal of Applied Physics 80 [10], 5682-5690 (1996).
Full Text: [ PDF]L. Klinger, L. Levin and D. Srolovitz, "Interface Diffusion Under an Electric Field: Interface Evolution", Materials Science Forum, 207-209, 109-112 (1996).
N. Sridhar, J. M. Rickman, D. J. Srolovitz, "Effect of Reinforcement Morphology on Matrix Microcracking", Acta Materialia 44 [3], 915-925 (1996).
J. R. Smith, J. E. Raynolds, E. R. Roddick, and D. J. Srolovitz, "An Atomistic View of Adhesion", Journal of Computer-Aided Materials Design 3, 169-172 (1996).
G. L. Zhao, J. R. Smith, J. Raynolds and D. J. Srolovitz, "First-Principles Study of the a-Al2O3(0001)/Cu(111) Interface", Interface Science 3 [4], 289-302 (1996).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Twinning in Thin Films: II. Equilibrium Microstructures", Acta Mater. 44 [10], 4097-4113 (1996).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Twinning in Thin Films: I. Elastic Analysis", Acta Mater. 44 [10], 4085-4096 (1996)
J. E. Raynolds, J. R. Smith, G.-L. Zhao, and D. J. Srolovitz, "Adhesion in NiAl-Cr from First Principles", Phys. Rev. B 53 [20], 13,883-13,890 (1996).
Full Text: [ PDF]L. E. Shilkrot and D. J. Srolovitz, "The Elastic Field Of A Surface Step: Atomistic Simulations And Anisotropic Elastic Theory", Physical Review B 53 [16], 11,120-11,127 (1996).
Full Text: [ PDF]L. Klinger, L. Levin and D. J. Srolovitz, "Morphological Stability of a Heterophase Interface under Electromigration Conditions", Journal of Applied Physics 79 [9], 6834-6839 (1996).
Full Text: [ PDF]R. W. Smith, D. J. Srolovitz, "Simulation of Dynamic Fracture of an Impact Loaded Brittle Solid: Microcracked and Polycrystalline Solids", Modelling and Simulation in Materials Science and Engineering 3 [5], 665-558 (1995).
R. W. Smith, R. Najafabadi, D. J. Srolovitz, "Segregation to an ao/2 [110] Dislocation in Ni0.9-Cu0.1", Acta Metallurgical et Materialia 43 [10], 3621-3632 (1995).
R. W. Smith and D. J. Srolovitz, "Void Formation During Thin Film Growth: A Molecular Dynamics Study", Journal of Applied Physics 79 [3], 1448-1457 (1996).
Full Text: [ PDF]S. Swaminarayan and D. J. Srolovitz, "Surface Segregation in Thin Films", Acta Metallurgica et Materialia, 44 [5], 2067-2072 (1996).
S. Swaminarayan, R. Najafabadi and D. J. Srolovitz, "Finite Size Effects on the Thermodynamics of Cu-Ni Alloys: {100} and {110} Thin Films", Acta Materialia 45 [4], 1715-1724 (1997).
L. Zhao, R. Najafabadi and D. J. Srolovitz, "Determination of Vacancy and Atomic diffusivities in Solid Solution Alloys, Acta Metallurgica et Materialia 44 [7], 2737-2749 (1996).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Elastic Analysis of Twinning in Misfitting Thin Films", Mat. Res. Soc. Symp. Proc. 389, 149-154 (1995).
C. Battaile, R. Najafabadi and D. J. Srolovitz, "Surface Phase Transitions in CaO-FeO and CaO-NiO", Proceedings of the American Ceramic Society, (1995).
N. Zacharopoulos, E. A. Holm and D. J. Srolovitz, "Simulation of Grain Growth during Directional Annealing", in Grain Size and Mechanical Properties-Fundamentals and Applications, Materials Research Society Symposium Proceedings, Vol. 362, p. 271-276 (1995).
C. Battaile, R. Najafabadi and D. J. Srolovitz, "Simulation of segregation to interfaces in metal-oxides", in Structure and Properties of Interfaces in Ceramics (ed. D. Bonnel, M. Rühle) Materials Research Society Symposium Proceedings, Vol. 357, 435-440 (1995).
Finnis, M.W., Needs, R.J., Schonberger, U., Smith, J.R., Hong, T., and Srolovitz, D. J., "Comment on "Metal-ceramic adhesion and the Harris functional" (and reply)", Physical Review Letters 74 [15], 3083-4 (1995).
Full Text: [ PDF]D. J. Srolovitz, S. A. Safran, M. Homyonfer, and R. Tenne, "Morphology of Nested Fullerenes", Physical Review Letters 74 [10], 1779 (1995).
Full Text: [ PDF]G. N. Hassold and D. J. Srolovitz, "Computer Simulation of Grain Growth with Mobile Particles", Scripta Metallurgica et Materialia 32 [10], 1541-1547 (1995).
R. Najafabadi and D. J. Srolovitz, "Evaluation of the Accuracy of the Free Energy Minimization Method", Physical Review B, 52 [13], 9229-41 (1995).
Full Text: [ PDF]C. Battaile, R. Najafabadi and D. J. Srolovitz, "Calculation of Segregation to Free Surfaces in Cubic Oxides", Journal of the American Ceramic Society 78 [12], 3195-3200 (1995).
D. J. Srolovitz and M. G. Goldiner, "Thermodynamics and Kinetics of Film Agglomeration", Journal of Metals 47 [3], 31-36 & 76-77 (1995).
R. Najafabadi and D. J. Srolovitz, "Interatomic Potentials for Elastically Isotropic Solids", Modelling and Simulation in Materials Science and Engineering 3 [5], 643-654 (1995).
Y. Feldman, E. Wasserman, D. Srolovitz and R. Tenne, "High Rate, Gas Phase Growth of MoS2 Nested Inorganic Fullerenes and Nanotubes", Science 267 [1], 222-225 (1995).
D. J. Srolovitz, S. M. Yalisove and J. C. Bilello, "Design of Multiscalar Metallic Multilayer Composites for High Strength, High Toughness and Low CTE Mismatch", Metallurgical Transactions 26A [7], 1805-1813 (1995).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Thermal Misfit and Thermal Fatigue Induced Damage in Brittle Composites", in Intermetallic Matrix Composites, (ed. J. A. Graves) Materials Research Society Symposium Proceedings 350, 267-272 (1994).
J. R. Smith, T. Hong and D. J. Srolovitz, "Effects of Impurities on Bonding: Application to the Mo/MoSi2 Interface", J. S. Faulkner and R. G. Jordan, eds. (Kluwer Academic Publishers, Groningen, Dordrecht, The Netherlands, 1994), pgs. 281-290.
S. Swaminarayan, R. Najafabadi and D. J. Srolovitz, "Polycrystalline surface properties from spherical crystallites: Ag, Au, Cu and Pt", Surface Science 306 [3], 367-380 (1994).
R. W. Smith and D. J. Srolovitz, "Simulation of Dynamic Fracture of an Impact Loaded Brittle Solid", Modelling and Simulation in Materials Science and Eng. 2 [6], 1153-1170 (1994).
N. Sridhar, J. M. Rickman and D. J. Srolovitz, "Thermoelastic Analysis of Matrix Crack Growth in Particulate Composites", Acta Metallurgica et Materialia 43 [4], 1669-1681 (1995).
T. Hong, J. R. Smith and D. J. Srolovitz, "Theory of Metal-Ceramic Adhesion", Acta Metallurgica et Materialia 43 [7], 2721-2730 (1995).
J. R. Smith, T. Hong and D. J. Srolovitz, "Metal-Ceramic Adhesion and the Harris Functional", Physical Review Letters 72 [25], 4021-4024 (1994).
Full Text: [ PDF]R. Najafabadi and D. J. Srolovitz, "Elastic Step Interactions on Vicinal Surfaces of FCC Metals", Surface Science 317, 221-234 (1994).
D. J. Srolovitz, S. A. Safran and R. Tenne, "Elastic Equilibrium of Curved Thin Films", Physical Review E 49 [6], 5260-5270 (1994).
Full Text: [ PDF]R. Najafabadi and D. J. Srolovitz, "The Effect of Surface Relaxation and Atomic Vibration on the Equilibrium Shape of Gold and Copper Crystallites", Journal of Computer-Aided Materials Design 1, 187-197 (1994).
L. Zhao, R. Najafabadi and D. J. Srolovitz, "Statistical Mechanical / Atomistic Determination of Vacancy Formation Free Energies in Cu-Ni Alloys", Philosophical Magazine A 70 [3], 519-529 (1994).
W. Yang and D. J. Srolovitz, "Surface Morphology Evolution in Stressed Solids: Surface Diffusion Controlled Crack Initiation", Journal of the Mechanics and Physics of Solids 42 [10], 1551-1574 (1994).
T. Hong, J. R. Smith, and D. J. Srolovitz, "Metal/Ceramic Adhesion: A First Principles Study of MgO/Al and MgO/Ag", Journal of Adhesion 8[8], 837-851 (1994).
N. Sridhar, W. Yang, D. J. Srolovitz and E. R. Fuller, "Microstructural Mechanics Model of Anisotropic-Thermal-Expansion -Induced Microcracking", J. Am. Ceram. Soc., 77[5] 1123-38 (1994)
J. P. Hirth and D. J. Srolovitz, "The Shape of Hollow Dislocation Cores", Philosophical Magazine A 69 [2], 341-347 (1994).
T. Hong, J. R. Smith, and D. J. Srolovitz, "Adhesion at a Heterophase Interface: First Principles Study of Mo(001)/MoSi2(001)", Interface Science 1, 223-236 (1993).
J. M. Rickman and D. J. Srolovitz, "Efficient Determination of All Thermodynamic Properties from a Single Simulation", Journal of Chemical Physics 99, 7993-7997 (1994).
Full Text: [ PDF]R. Najafabadi, D. J. Srolovitz, E. Ma, and M. Atzmon, "Thermodynamic Properties of Metastable Ag-Cu Alloys: Atomistic Simulation, CALPHAD Calculations, and Experiment", J. Appl. Phys. 74, 3144 (1993).
Full Text: [ PDF]C. D. Adams, D. J. Srolovitz, and M. Atzmon, "Monte Carlo Simulation of Phase Separation During Thin Film Co-Deposition", Journal of Applied Physics 74, 1707-1715 (1993).
Full Text: [ PDF]T. Hong, J. R. Smith and D. J. Srolovitz, "First Principles Study of Interfacial Adhesion: The Mo/MoSi2 Interface with and without Impurities", in Joining and Adhesion of Advanced Inorganic Materials, Materials Research Society Symposium Proceedings, 3-14, (1993).
L. Zhao, R. Najafabadi and D. J. Srolovitz, "An Atomistic Study of Surface Vacancy Diffusion", Materials Research Society Symposium Proceedings 311, 355-360 (1993).
L. Zhao, R. Najafabadi and D. J. Srolovitz, "Methods for Determining Vacancy Formation Thermodynamics", Materials Research Society Symposium Proceedings 291, 455-460 (1993).
R. Najafabadi and D. J. Srolovitz, "Segregation to Tilt Grain Boundaries in Ni3+xAl1-x Alloys: A Free Energy Minimization Study", ed. I. Baker, R. Darolis, J. D. Wittenberger and M. H. Yoo, Materials Research Society Symposium Proceedings 288, 189-195 (1993).
W. H. Yang and D. J. Srolovitz, "Crack-like Surface Instabilities in Stressed Solids", Physical Review Letters 71, 1593-1596 (1993).
Full Text: [ PDF]T. Hong, J. R. Smith and D. J. Srolovitz, "Impurity Effects on Adhesion", Physical Review Letters 70, 615-618 (1993).
Full Text: [ PDF]T. Hong, J. R. Smith and D. J. Srolovitz, "Impurity Effect on Adhesion: Nb, C, O, B, and S at a Mo/MoSi2 Interface", Phys. Rev. B 47, 13,615-13,625 (1993).
L. Zhao, R. Najafabadi, and D. J. Srolovitz, "Finite Temperature Vacancy Formation Thermodynamics: Local Harmonic and Quasiharmonic Studies", Modeling and Simulation in Materials Science and Eng. 1, 539-551 (1993).
R. Najafabadi and D. J. Srolovitz, "Order-Disorder Transitions at and Segregation to (001) Ni-Pt Surfaces", Surface Science 286, 104-115 (1993).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz and R. LeSar, "Segregation To and Structure Of [001] Twist Grain Boundaries in Cu-Ni Alloys", Acta Met. Mat. 41, 2533-2546 (1993).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz and R. LeSar, "Interfacial Segregation in Ag-Au, Au?Pd, and Cu-Ni Alloys: II. [001] S5 Twist Grain Boundaries", Interface Science 1, 31-47 (1993).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz and R. LeSar, "Interfacial Segregation in Ag-Au, Au?Pd, and Cu-Ni Alloys: I. (001) Surfaces", Interface Science 1, 7-30 (1993).
J. M. Rickman and D. J. Srolovitz, "A Modified Local Harmonic Model for Solids", Philosophical Magazine, A 67, 1081-1094 (1993).
J. M. Rickman and D. J. Srolovitz, "Defect Interactions on Solid Surfaces", Surface Science 284, 211-221 (1993).
E. A. Holm, D. J. Srolovitz and J. W. Cahn, "Microstructural Evolution in Two-Dimensional Two-Phase Polycrystals", Acta Met. Mat. 41, 1119-1136 (1993).
J. M. Rickman, R. Najafabadi, and D. J. Srolovitz, "Finite-Temperature Properties from a Single Zero-Temperature Minimization", in Computational Methods in Materials Science (Materials Research Society Symposium Proceedings), 369-375 (1992).
G. S. Grest, J. A. Glazier, M. P. Anderson, E. A. Holm and D. J. Srolovitz, "Coarsening in Two-Dimensional Soap Froths and the Large-Q Potts Model", Materials Research Society Symposium Proceedings 237, 101-111 (1992).
T. Hong, J. R. Smith, D. J. Srolovitz, J. G. Gay, and R. Richter, "Determining ab initio Interfacial Energetics", Physical Review B 45, 8775-8778 (1992).
M. Atzmon, D. A. Kessler, and D. J. Srolovitz, "Phase Separation During Film Growth", Journal of Applied Physics 72, 442-446 (1992).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz, and R. LeSar, "(100) Surface Segregation in Cu-Ni Alloys", Phys. Rev. B 45, 12,028-12,042 (1992).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz, and R. LeSar, "Segregation Effects on the Fracture of Grain Boundaries in Ni-Cu Alloys: An Atomistic Simulation Study of Ni-Cu Alloys", Met. Trans. 23A, 3105-3113 (1992).
J. M. Rickman, R. Najafabadi, L. Zhao and D. J. Srolovitz, "Finite Temperature Properties of Perfect Crystals and Defects from Zero-Temperature Energy Minimization", Journal of Physics: Condensed Matter 4, 4923-4934 (1992).
J. R. Smith and D. J. Srolovitz, "Developing Potentials for Atomistic Simulations: Workshop Report", Modeling and Simulation in Materials Science and Engineering, 1, 101-109 (1992).
R. LeSar and D. J. Srolovitz, "Modelling of Transformation Toughening in Brittle Materials," Materials Science and Engineering A, 155, 267-274 (1992).
R. Gibala, A. K. Ghosh, D. C. Van Aken, D. J. Srolovitz, A. Basu, H. Chang, D. P. Mason, and W. Yang, "Mechanical Behaviour and Interface Design of MoSi2-Based Alloys and Composites," Materials Science and Engineering A 155, 147-158 (1992).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz and R. LeSar, "Segregation to S5 [001] Twist Grain Boundaries in Ni-Cu Alloys", Philosophical Magazine A 65, 625-655 (1992).
C. D. Adams, M. Atzmon, Y.-T. Cheng and D. J. Srolovitz, "Phase Separation During Co-Deposition of Al-Ge Thin Films", Journal of Materials Research 7, 653-666 (1992).
R. D. Rollett, M. J. Luton and D. J. Srolovitz, "Microstructural Simulation of Dynamic Recrystallization", Acta Metallurgica et Materialia 40, 43-55 (1992).
A. D. Rollett, D. J. Srolovitz, R. D. Doherty, and M. P. Anderson, "Computer Simulation of Recrystallization: III. Influence of a Dispersion of Fine Particles", Acta Metallurgica et Materialia, 40, 3475-3495 (1992).
H. Y. Wang, R. Najafabadi, D. J. Srolovitz and R. LeSar, "The Free Energy Simulation Approach to Grain Boundary Segregation in Cu-Ni," Defects in Materials, ed. P. D. Bristowe, J. E. Epperson, J. E. Griffith, and Z. Liliental-Weber, Materials Research Society Symposium Proceedings 209, 219-224 (1991).
E. A. Holm and D. J. Srolovitz, "Effects of Inert Particle Morphology on Grain Growth in Composites," Morris E. Fine Symposium, ed. P. K. Liaw, J. R. Weertman, H. L. Marcus and J. S. Santner (The Minerals, Metals, & Materials Society, Warrendale, Pennsylvania, 1991), pg. 187-192.
R. Najafabadi, H. Y. Wang, D. J. Srolovitz and R. LeSar, "Free Energy Simulation of Grain Boundary Segregation and Thermodynamics in Ni3-xAlx", in High Temperature Ordered Intermetallic Alloys, eds. L. Johnson, D. P. Pope, and J. O. Stiegler, Materials Research Society Symposium Proceedings, 203, 51-56 (1991).
M. Atzmon, C. D. Adams, Y.-T. Cheng, and D. J. Srolovitz, "Phase Separation during Film Deposition" in Evolution of Thin Film and Surface Microstructure, eds. J. Y. Tsao, C. V. Thompson and D. J. Srolovitz, Materials Research Society Symposium Proceedings, 202, 143-153 (1991).
C. D. Adams, M. Atzmon, Y.-T. Cheng and D. J. Srolovitz, "Al-Ge Phase Separation During Vapor Deposition", in Thin Film Structures and Phase Stability, eds. B. M. Clemens and W. L. Johnson, Materials Research Society Symposium Proceedings 202, 143-153 (1991).
R. Najafabadi, H. Y. Wang, D. J. Srolovitz, and R. LeSar, "The Effects of Segregation on Grain Boundary Cohesive Energies in Ni3-xAl1+x", Scripta Metallurgica et Materialia 25, 2497-2502 (1991).
C. D. Adams, M. Atzmon, Y. T. Cheng and D. J. Srolovitz, "A Transition from Lateral to Transversed Phase Separation During Film Co-Deposition," Applied Physics Letters 59, 2535-2537 (1991).
R. Najafabadi, H. Y. Wang, D. J. Srolovitz, and R. LeSar, "A New Method for the Simulation of Alloys: Application to Interfacial Segregation", Acta Metallurgica et Materialia, 39, 3071-3082 (1991).
R. LeSar, R. Najafabadi and D. J. Srolovitz, "Variational Calculations of Solid and Liquid Metals Described by Embedded-Atom-Model Potentials", Journal of Chemical Physics 94, 5090-5097 (1991).
E. A. Holm, J. A. Glazier, D. J. Srolovitz and G. S. Grest, "The Effects of Lattice Anisotropy and Temperature on Domain Growth in the Two Dimensional Potts Model", Physical Review A 43, 2662-2668 (1991)
D. J. Srolovitz and J. P. Hirth, "Elastic Analysis of the Energy and Relaxation of Stepped Surfaces", Surface Science 255, 111-119 (1991).
R. Najafabadi, D. J. Srolovitz and R. LeSar, "Thermodynamic and Structural Properties of [001] Twist Boundaries in Gold", Journal of Materials Research 6, 999 (1991).
M.E. Sherwin, T.J. Drummond and D. J. Srolovitz, "The Role of Surface Tension in the Growth of Strained Quantum Wire Arrays", Journal of Applied Physics 62, 717-721 (1991).
R. D. Doherty, K. Li, M. P. Anderson, A. D. Rollett and D. J. Srolovitz, "Modelling of Recrystallization Kinetics and Particle Limited Grain Boundary Motion", in Recrystallization '90 (TMS, Warrendale, PA, 1990).
A. D. Rollett, D. J. Srolovitz, R. D. Doherty, M. P. Anderson and G. S. Grest, "Computer Simulation of Recrystallization in the Presence of Second Phase Particles", in Simulation and Theory of Evolving Microstructures, eds. M. P. Anderson and A. D. Rollett (The Metallurgical Society, Warrendale, Pennsylvania, 1990), pg. 103-110.
K. H. Chang, R. Gibala, D. J. Srolovitz, P. K. Bhattacharya, and J. F. Mansfield, "Surface Cross-Hatched Morphology on Strained III-V Semiconductor Heterostructures", in Layered Structures: Heteroepitaxy, Superlattices, Strain and Metastability, eds. L. J. Schowalter, et al., Materials Research Society Symposium Proceedings 160, 129-134 (1990).
W. H. Yang, D. J. Srolovitz, G. N. Hassold and M. P. Anderson, "Microstructural Effects in the Fracture of Brittle Materials", in Simulation and Theory of Evolving Microstructures, eds. M. P. Anderson and A. D. Rollett (The Metallurgical Society, Warrendale, Pennsylvania, 1990), pg. 277-284.
A. Gulluoglu, D. J. Srolovitz, R. LeSar and P. S. Lomdahl, "Dynamical Simulation of Dislocation Microstructure", in Simulation and Theory of Evolving Microstructures, eds. M. P. Anderson and A. D. Rollett (The Metallurgical Society, Warrendale, Pennsylvania, 1990), pg. 239-248.
A. D. Rollett, D. J. Srolovitz and M. J. Luton, "Microstructural Simulation of Dynamic Recrystallization", in Simulation and Theory of Evolving Microstructures, eds. M. P. Anderson and A. D. Rollett (The Metallurgical Society, Warrendale, Pennsylvania, 1990), pg. 111-118.
E. A. Holm, G. N. Hassold and D. J. Srolovitz, "Effects of Inert Particle Morphology on Two-Dimensional Grain Growth", in Simulation and Theory of Evolving Microstructures, eds. M. P. Anderson and A. D. Rollett (The Metallurgical Society, Warrendale, Pennsylvania, 1990), pg. 57-64.
G. S. Grest, M. P. Anderson, D. J. Srolovitz and A. D. Rollett, "Abnormal Grain Growth in Three Dimensions", Scripta Metallurgica et Materialia 24, 661 (1990).
R. Najafabadi, D. J. Srolovitz and R. A. LeSar, "Influence of Anisotropic Vibrational Motion on Diffraction from Grain Boundaries", Scripta Metallurgica 24, 251-256 (1990).
G. N. Hassold, E. A. Holm and D. J. Srolovitz, "Effects of Particle Size on Inhibited Grain Growth", Scripta Metallurgica 24, 101-106 (1990).
P. E. Magnusen, D. J. Srolovitz and D. A. Koss, "A Simulation of Void Linking during Ductile Fracture", Acta Metallurgica 38, 1013-1022 (1990).
K. H. Chang, R. Gibala, D. J. Srolovitz, P. K. Bhattacharya and J. F. Mansfield, "Cross-Hatched Surface Morphology In Strained III-V Semiconductor Films", Journal of Applied Physics 67, 4093-4098 (1990).
R. Najafabadi, D. J. Srolovitz and R. LeSar, "Finite Temperature Structure and Thermodynamics of the Au S5 (001) Twist Boundary", Journal of Materials Research 5, 2663-2676 (1990).
I. Wei Chen, H. N. Hassold and D. J. Srolovitz, "Computer Simulation of Late Stage Sintering: II. Influence of Initial Pore Size", Journal of the American Ceramics Society 73 2865-2872 (1990).
H. N. Hassold, I. Wei Chen and D. J. Srolovitz, "Computer Simulation of Late Stage Sintering: I. Model, Kinetics and Microstructure", Journal of the American Ceramics Society, 73 2857-2864 (1990).
W. D. Wilson, R. J. Asaro, R. H. Boyd, R. W. Dutton, W. A. Goddard, J. M. Sanchez, J. R. Smith, D. J. Srolovitz, and W. G. Wolfer, "The Impact of Supercomputing Capabilities on U. S. Materials Science and Technology," Future Generations of Computer Systems 5, 283-293 (1989).
D. Farkas, A. F. Voter, D. J. Srolovitz and S. P. Chen, "Oscillatory Relaxations in (111) Planar Defects in Ni3Al", Philosophical Magazine A60, 433-446 (1989).
A. N. Gulluoglu, D. J. Srolovitz, R. LeSar and P. S. Lomdahl, "Dislocation Distributions in Two Dimensions", Scripta Metallurgica 23, 1347-1352 (1989).
R. LeSar, R. Najafabadi and D. J. Srolovitz, "Finite-Temperature Defect Properties from Free Energy Minimization", Physical Review Letters 63, 624-627 (1989).
M. P. Anderson, G. S. Grest, R. D., K. Li and D. J. Srolovitz, "Inhibition of Grain Growth by Second Phase Particles: Three Dimensional Monte Carlo Computer Simulations", Scripta Metallurgica 23, 753-758 (1989).
J.E. Hack, D. J. Srolovitz and S.P. Chen, "A Model for the Fracture Behavior of Polycrystalline Ni3Al," Scripta Metallurgica 20, 1699-1704 (1989).
J. E. Hack, S. P. Chen and D. J. Srolovitz, "A Kinetic Criterion for Quasi-Brittle Fracture", Acta Metallurgica 37, 1957-1970 (1989).
R. Eykholt and D. J. Srolovitz, "The Dynamics of Free, Straight Dislocation Pairs II: Edge Dislocations", Journal of Applied Physics 65, 4204-4211 (1989).
R. Eykholt, S. A. Trugman and D. J. Srolovitz, "The Dynamics of Free, Straight Dislocation Pairs I: Screw Dislocations", Journal of Applied Physics 65, 4198-4203 (1989).
G. N. Hassold and D. J. Srolovitz, "Brittle Fracture in Materials with Random Defects", Physical Review B39, 9273-9281 (1989).
A. Mazor, B. G. Bukiet and D. J. Srolovitz, "The Effect of Vapor Incidence Angle Upon Thin Film Columnar Growth", Journal of Vacuum Science and Technology A7, 1386-1391 (1989).
A. D. Rollett, D. J. Srolovitz, R. D. Doherty and M. P. Anderson, "Computer Simulation of Recrystallization in Non-Uniformly Deformed Metals", Acta Metallurgica 37, 627-639 (1989).
D. J. Srolovitz, "On the Stability of Stressed Surfaces", Acta Metallurgica 37, 621-625 (1989).
A. D. Rollett, D. J. Srolovitz and M. P. Anderson, "Simulation and Theory of Abnormal Grain Growth-Anisotropic Grain Boundary Energies and Mobilities," Acta Metallurgica 37, 1227-1240 (1989).
S. P. Chen, A. F. Voter and D. J. Srolovitz, "Computer Simulation of Surfaces and [001] Symmetric Tilt Grain Boundaries in Ni, Al and Ni3Al", Journal of Materials Research 4, 62-77 (1989).
D. J. Srolovitz, G. N. Hassold and J. Gayda, "Monte Carlo Simulations of Modulated Phases", in Dynamics of Ordering Processes in Condensed Matter, eds. K. Kawasaki and S. Komura, pg. 111-120, 1988.
S.P. Chen, A.F. Voter and D. J. Srolovitz, "A Simulation Study of Interfaces in Ni, Al and Ni3Al with and without Boron," in Interface Science and Engineering '87, Journal de Physics 49, C5-157-C5-263, (1988).
D. J. Srolovitz, G. S. Grest, G. N. Hassold and R. Eykholt, "Effects of Impurities on Domain Growth", in Competing Interactions and Microstructures: Statics and Dynamics, eds. R. LeSar, A. Bishop and R. Heffner, (Springer-Verlag, Berlin, 1988), pg. 254-262.
D. J. Srolovitz, A. Mazor, B. G. Bukiet and P. S. Hagan, "Summary Abstract: Theory and simulations of zone II microstructures in thin films", J. Vac. Sci. Tech. A6, 1640-1641 (1988).
A. Mazor, D. J. Srolovitz, P. S. and B. G. Bukiet, "Columnar Growth in Thin Films", Physical Review Letters 60, 424-427 (1988).
D. J. Srolovitz, G. S. Grest, M. P. Anderson and A. D. Rollett, "Computer Simulation of Recrystallization: II. Heterogeneous Nucleation and Growth", Acta Metallurgica 36, 2115-2128 (1988).
G. S. Grest, M. P. Anderson and D. J. Srolovitz, "Computer Simulation of Normal Grain Growth in Three Dimensions", Philosophical Magazine B59, 293-329 (1988).
D. J. Srolovitz, A. Mazor and B. G. Bukiet, "Analytical and Numerical Modeling of Columnar Evolution in Thin Films", Journal of Vacuum Science and Technology A6, 2371-2380 (1988).
D. J. Srolovitz and P. D. Beale, "Computer Simulation of Failure in an Elastic Model with Randomly Distributed Defects," Journal of the American Ceramics Society 71, 362-369 (1988).
G.N. Hassold and D. J. Srolovitz, "Ordering in the Quenched Two-Dimensional ANNNI Model," Physical Review B37, 3467-3479 (1988).
P. D. Beale and D. J. Srolovitz, "Elastic Fracture in Random Materials", Physical Review B37, 5500-5507 (1988).
A. Mazor, D. J. Srolovitz, P. S. Hagan and B. G. Bukiet, "Thin Film Microstructures: Simulation and Theory", Society of Photo-Optical Instrumentation Engineers 821, 88-94 (1987).
G. S. Grest, M. P. Anderson and D. J. Srolovitz, "Comparison of Domain Growth Kinetics in Two and Three Dimensions", in Time Dependent Effects in Disordered Materials, eds. R. Pynn and T. Riste (Plenum, New York, 1987), pg. 365-382.
S.P. Chen, A.F. Voter and D. J. Srolovitz, "Surface Relaxation in Ordered Intermetallic Alloys," in Characterization of Defects in Materials, Siegel, Sinclair and Weertman, eds., Materials Research Society Symposium Proceedings 82, 515-521 (1987).
S.P. Chen, A.F. Voter and D. J. Srolovitz, "Computer Simulation of Grain Boundaries in Ni, Al and Ni3Al," in High Temperature Ordered Intermetallic Alloys, Izumi, Koch, Liu and Stoloff eds., Materials Research Society Symposium Proceedings 81, 45 (1987).
D. J. Srolovitz and G. N. Hassold, "Growth Kinetics in a Frustrated System", in Incommensurate Crystals, Liquid Crystals and Quasi-Crystals, eds. J. F. Scott and N. A. Clark, (Plenum, New York), pg. 63-73, 1987.
R. D. Doherty, D. J. Srolovitz, A. D. Rollett and M. P. Anderson, "On the Volume Fraction Dependence of Particle Limited Grain Growth", Scripta Metallurgica 21, 675-679 (1987).
D. J. Srolovitz, R. Eykholt, D.M. Barnett and J.P. Hirth, "Moving Discommensuration Interacting with Diffusing Impurities," Physical Review B35, 6107-6121 (1987).
D. J. Srolovitz and G.N. Hassold, "Effects of Diffusing Impurities on Domain Growth in the Ising Model," Physical Review B35, 6902-6910 (1987).
R. Eykholt and D. J. Srolovitz, "Surface Segregation During Deposition," Journal of Applied Physics 60, l793-1796 (l986).
D. J. Srolovitz, "Grain Growth Phenomena in Films," Journal of Vacuum Science and Technology, A4, 2925-2931 (1986).
D. J. Srolovitz and P.S. Lomdahl, "Dislocation Dynamics in the 2-D Frenkel-Kontorova Model," Physica 23D, 402-412 (1986).
R.D. Doherty, A.R. Rollett and D. J. Srolovitz, "Structural Evolution During Recrystallization," in Annealing Processes - Recovery, Recrystallization and Grain Growth, ed. N. Hansen, et al., (Riso National Lab., Roskilde, Denmark, 1986), pg. 53-67.
M.P. Anderson, G.S. Grest and D. J. Srolovitz, "Microstructural Dynamic Study of Recrystallization and Grain Growth, in Computer Based Microscopic Description of the Structure and Properties of Materials, eds. J. Broughton, W. Krakow and S.T. Pantelides, Materials Research Society Symposium Proceedings 63, 225-231 (1986).
M.P. Anderson, G.S. Grest and D. J. Srolovitz, "Microstructural Dynamic Study of Recrystallization," in Computer Simulation of Microstructural Evolution, ed. D. J. Srolovitz, pg. 77-94, l986.
G.S. Grest, M.P. Anderson, D. J. Srolovitz, "Computer Simulation of Microstructural Dynamics," in Computer Simulation of Microstructural Evolution, ed. D. J. Srolovitz, pg. 2l-32, l986.
S.A. Safran and D. J. Srolovitz, "Kinetics of Instabilities in Solid Films," Europhysics Letters 2, 6l-66 (l986).
P.S. Lomdahl and D. J. Srolovitz, " Dislocation Generation in the Two-Dimensional Frenkel-Kontorova Model at High Stresses," Physical Review Letters 57, 2702-2705 (1986).
S.P. Chen, A.F. Voter and D. J. Srolovitz, "Oscillatory Surface Relaxations in Ni, Al and Their Ordered Alloys," Physical Review Letters 57, l308-1311 (l986).
S.P. Chen, A. Voter and D. J. Srolovitz, "Computer Simulation of Grain Boundaries in Ni3Al: The Effect of Grain Boundary Composition," Scripta Metallurgica 20, 1389-1394 (1986).
D. J. Srolovitz and J. Scott, "Clock-Model Descriptions of Incommensurate Ferro-electric Films and Nematic Liquid Crystals," Physical Review B34, l8l5-1819 (l986).
D. J. Srolovitz and S.A. Safran, "Capillary Instabilities in Thin Films: II. Kinetics," Journal of Applied Physics, 60, 255-260 (l986).
D. J. Srolovitz, G.S. Grest and M.P. Anderson, "Computer Simulation of Recrystallization: I. Homogeneous Nucleation and Growth," Acta Metallurgica 34, l833-1845 (l986).
D. J. Srolovitz and C. V. Thompson, "Beading Instabilities in Thin Film Lines with Bamboo Microstructures," Thin Solid Films l39, l33-141 (l986).
D. J. Srolovitz and S.A. Safran, "Capillary Instabilities in Thin Films: I. Energetics," Journal of Applied Physics 60, 247-254 (l986).
D. J. Srolovitz and S.A. Safran, "Capillary Instabilities in Thin Polycrystalline Films," in Thin Films: The Relationship of Structure to Properties, eds. C.R. Aita and K.S. SreeHarsha, Materials Research Society Symposium Proceedings 47, 53-60 (l985).
D. J. Srolovitz, M.P. Anderson and G.S. Grest, "Microstructural Dynamics: A Monte Carlo Approach," in Interface Migration and Control of Microstructure, eds. C.S. Pande and D.A. Smith, ASM, pg. 155-160, l985.
M.P. Anderson, G.S. Grest and D. J. Srolovitz, "Grain Growth in Three Dimensions: A Lattice Model," Scripta Metallurgica l9, 225-230 (l985).
T. A. Ramanarayanan and D. J. Srolovitz, "Carburization Mechanisms of High Chromium Alloys," Journal of the Electrochemical Society 132, 2268-2274 (1985).
D. J. Srolovitz, G.S. Grest and M.P. Anderson, "Computer Simulation of Grain Growth: V. Abnormal Grain Growth," Acta Metallurgica 33, 2233-2247 (l985).
D. J. Srolovitz and G.S. Grest, "Impurity Effects on Domain Growth Kinetics. II. Potts Model, Physical Review B32, 302l-3025 (l985).
D. J. Srolovitz and G.S. Grest, "Impurity Effects on Domain Growth Kinetics: I. Ising Model," Physical Review B32, 30l4-3020 (l985).
D. J. Srolovitz and S.A. Safran, "Capillary Equilibria of Surfaces Intersected by Dislocations," Philosophical Magazine 52, 793-800 (l985).
G.S. Grest, D. J. Srolovitz and M.P. Anderson, "Computer Simulation of Grain Growth: IV. Anisotropic Grain Boundary Energies," Acta Metallurgica 33, 509-520 (l985).
M. P. Anderson, D. J. Srolovitz, G. S. Grest and P. S. Sahni, Computer Simulation of Grain Growth in Polycrystalline Aggregates, Materials Research Society Symposium 21, 467-473 (1984)
D. J. Srolovitz, R. A. Petkovic-Luton and M. J. Luton, "Straight Dislocaton-Spherical Inclusion Interactions," Scripta Metallurgica 18, 1063-1068 (1984).
G.S. Grest, D. J. Srolovitz and M.P. Anderson, "Kinetics of Domain Growth: Universality of Kinetic Exponents," Physical Review Letters 52, l32l-1324 (l984).
G.S. Grest and D. J. Srolovitz, "Structure and Evolution of Quenched Ising Clusters," Physical Review B30, 5l50-5155 (l984).
D. J. Srolovitz and T.A. Ramanarayanan, "Thermochemical Diagrams for Metal-Oxygen-Sulfur Systems," Oxidation of Metals 22, 247-275 (l984).
G.S. Grest and D. J. Srolovitz, "Vortex Effects on Domain Growth: The Clock Model," Physical Review B30, 6535-6539 (l984).
D. J. Srolovitz, M.P. Anderson, G.S. and P.S. Sahni, "Computer Simulation of Grain Growth: III. Influence of a Particle Dispersion," Acta Metallurgica 32, l429-1438 (l984).
D. J. Srolovitz and T.A. Ramanarayanan, "An Elastic Analysis of Growth Stress During Oxidation," Oxidation of Metals 22, l33-146 (l984).
D. J. Srolovitz and M.P., "A Criterion for Compressive Failure of a Continuous, Protective Surface Film," Acta Metallurgica 32, l089-1092 (l984).
D. J. Srolovitz, R. Petkovic-Luton, M.J. Luton, D.M. Barnett and W.D. Nix, "Diffusionally Modified Dislocation-Particle Elastic Interactions," Acta Metallurgica 32, l079-1088 (l984).
D. J. Srolovitz, M.P. Anderson, P.S. Sahni and G.S. Grest, "Computer Simulation of Grain Growth: II. Grain Size Distribution, Topology and Local Dynamics," Acta Metallurgica 32, 793-802 (l984).
M.P. Anderson, D. J. Srolovitz, G.S. Grest and P.S. Sahni, "Computer Simulation of Grain Growth: I. Kinetics," Acta Metallurgica 32, 783-791 (l984).
M.P. Anderson, D. J. Srolovitz, P.S. Sahni and G.S. Grest, "Monte Carlo Simulation of Grain Growth," Proceedings of the International Conference on Phase Transitions, Kania, Crete, l983.
R. Petkovic-Luton, D. J. Srolovitz and M.J. Luton, "Microstructural Aspects of Creep and Dispersion Strengthened Systems," Proc. of Conf. Frontiers of High Temperature Materials II, l983.
D. J. Srolovitz, M.P. Anderson, G.S. Grest and P.S. Sahni, "Grain Growth in Two Dimensions," Scripta Metallurgica l7, 24l-246 (l983).
P.S. Sahni, G.S. Grest, M.P. Anderson and D. J. Srolovitz, "Kinetics of the Q-State Potts Model in Two Dimensions," Physical Review Letters 50, 263-266 (l983).
D. J. Srolovitz, R.A. Petkovic-Luton and M.J. Luton, "On Dislocation-Incoherent Particle Interactions at High Temperatures," Scripta Metallurgica l6, l40l-1406 (l983).
P.S. Sahni, D. J. Srolovitz, G.S. Grest, M.P. Anderson and S.A. Safran, "Kinetics of Ordering in Two Dimensions: Quenched Systems," Physical Review B28, 2705-2716 (l983).
D. J. Srolovitz, R. Petkovic-Luton and M.J. Luton, "Diffusional Relaxation of the Dislocation-Inclusion Repulsion," Philosophical Magazine 48, 795-809 (l983).
D. J. Srolovitz, R. Petkovic-Luton and M.J. Luton, "Edge Dislocation-Circular Inclusion Interactions at Elevated Temperatures," Acta Metallurgica 3l, 2l5l-2159 (l983).
D. Srolovitz, V. Vitek and T. Egami, "An Atomistic Study of Deformation of Amorphous Metals," Acta Metallurgica 3l, 335-352 (l983).
V. Vitek, D. Srolovitz and T. Egami, "Micromechanisms of Plastic Deformation in Metallic Glasses," in Amorphous Materials: Modeling of Structure and Properties, ed. Vitek, (The Metallurgical Society of AIME, New York, l982), pg. 333-340.
T. Egami and D. Srolovitz, "Local Structural Fluctuations in Amorphous and Liquid Metals: A Simple Theory of the Glass Transition," Journal of Physics F l2, 2l4l-2163 (l982).
V. Vitek, D. Srolovitz and T. Egami, "Atomic Level Deformation Properties of Amorphous Metals: A Computer Simulation Study," Proc. 4th Int. Conf. on Rapidly Quenched Metals, pg. 241-244, l98l.
D. Srolovitz, T. Egami and V. Vitek, "Local Structure and the RDF of Amorphous Metals," Proc. 4th Int. Conf. on Rapidly Quenched Metals, pg. 263-266, l98l.
T. Egami, V. Vitek and D. Srolovitz, "Microscopic Model of Structural Relaxation in Amorphous Alloys," Proc. 4th Int. Conf. on Rapidly Quenched Metals, pg. 5l7-522, l98l.
D. Srolovitz, T. Egami and V. Vitek, "The Radial Distribution Function and Structural Relaxation in Amorphous Solids," Physical Review B24, 6936-6944 (l98l).
D. Srolovitz, K. Maeda, S. Takeuchi, T. Egami and V. Vitek, "Local Structure and Topology of a Model Amorphous Metal," Journal of Physics F 11, 2209-2219 (1981).
D. Srolovitz, K. Maeda, V. Vitek and T. Egami, "Structural Defects in Amorphous Solids: Statistical Analysis of a Computer Model," Philosophical Magazine A44, 847-866 (l98l).
T. Egami, K. Maeda, D. Srolovitz and V. Vitek, "Local Atomic Structure of Amorphous Metals," Journal de Physique 4l, C8-272-C8-275 (l980).
Books
Modeling and Simulation of Thin-Film Processing, eds. David J. Srolovitz, Cynthia A. Volkert, Michael J. Fluss, and Robert J. Kee, (Materials Research Society, Pittsburgh, 1995), Materials Research Society Symposium Proceedings, Volume 389.
Evolution of Thin Film and Surface Microstructure, eds. J. Y. Tsao, C. V. Thompson and D. J. Srolovitz, (Materials Research Society, Pittsburgh, 1991), Materials Research Society Symposium Proceedings, Volume 202.
Atomistic Simulations of Materials: Beyond Pair Potentials, eds. V. Vitek and D. J. Srolovitz, Plenum, NY (1989).
Computer Simulation of Microstructural Evolution, ed. D. J. Srolovitz, AIME, Warrendale, Pa. (1986).
Chapters in books
D. J. Srolovitz, R. Najafabadi and V. M. Nabutovsky, "Order-Disorder Transitions At (001) Metal Surfaces", in Advances in Physical Metallurgy, ed. S. Banerjee and R. V. Ramanujan, (Gordon and Breach, New York, 1995), pg. 200-211.
D. J. Srolovitz, "Computer Simulation of Microstructural Evolution", in Encyclopedia of Advanced Materials, ed. D. Bloor, R. J. Brook, M. C. Flemings, & S. Mahajan (Pergamon Press, Oxford, 1994).
M. A. Grinfeld and D. J. Srolovitz, "Stress Driven Morphological Instabilities and Islanding of Epitaxial Films", in Properties of Strained and Relaxed Silicon Germanium, ed. E. Kasper (INSPEC, IEE, 1994), pg. 3-16.
D. J. Srolovitz, W. H. Yang, R. Najafabadi, H. Y. Wang, and R. LeSar, "Microstructural and Segregation Effects in the Fracture of Polycrystals", in Atomic-Level Properties of Interface Materials, ed. D. Wolf and S. Yip (Chapman and Hall, London, 1992), pg. 691-702.
D. J. Srolovitz, "Computer Simulation of Microstructural Evolution", in Advances in Materials Science & Engineering - 2nd Supplementary Volume of the Encyclopedia of Materials Science and Engineering, ed. R. W. Cahn (Pergamon Press, Oxford, 1990), pg. 845-854.
Government, University or industrial reports (non-refereed)
D. J. Srolovitz, J. E. Raynolds, E. R. Roddick and J. R. Smith, Predicting Adhesion Between Materials, in Gather - Scatter, the magazine of the San Diego Supercomputer Center, 1997.
M. Bernstein, R. B. Pipes, D. G. Backman, H. K. Bowen, J. P. Clark, T. C. McGill, M. V. Nevitt, D. J. Srolovitz, B. G. Streetman, K. F. Wissbrun, Report of Panel on Manufacturing of and with Advanced Engineered Materials, Committee on Research Directions and Needs in U.S. Manufacturing, National Research Council, 1990.
J. Gayda and D. J. Srolovitz, "A Microstructural Lattice Model for Strain Oriented Problems: A Combined Monte Carlo Finite Element Technique," NASA Technical Memorandum 100215 (1987).
W. D. Wilson, R. J. Asaro, R. H. Boyd, R. W. Dutton, W. A. Goddard, J. M. Sanchez, J. R. Smith, D. J. Srolovitz, and W. G. Wolfer, "The Impact of Supercomputing Capabilities on U. S. Materials Science and Technology," (National Academy Press, Washington D. C., 1988) National Materials Advisory Board Publication 451.
Patents
M. P. Anderson, L. M. Monette, J. P. Dismukes, S. Ling and D. J. Srolovitz, US Patent, Composites and Methods of Making the Same, Issued 8/98 (proprietor-Exxon Research and Engineering Co.)
M. P. Anderson, L. M. Monette, J. P. Dismukes, S. Ling and D. J. Srolovitz, European Patent 0532288, Composites and Methods of Making the Same, Issued 11/5/97 (proprietor-Exxon Research and Engineering Co.)