|
2009 |
Solidification microstructures and solid-state parallels: Recent developments,
future directions, M. Asta, C. Beckermann, A. Karma, W. Kurz, R. Napolitano,
M. Plapp, G. Purdy, M. Rappaz, R. Trivedi,
Acta Mater. 57, 941 (2009) |
| |
Temperature dependence of the surface free energy and surface stress: An atomistic
calculation for CU(110), T. Frolov and Y. Mishin,
Phys. Rev. B 79, 045430 (2009) |
| |
Modeling texture evolution during recrystallization in aluminum,
A. Brahme, J. Fridy, H. Weiland, and A. Rollett,
Modelling Simul. Mater. Sci. Eng. 17, 015005 (2009) |
| |
Effect of material properties on liquid metal embrittlement in the Al-Ga system
, H.-S. Nam and D. J. Srolovitz,
Acta Mater. 57, 1546 (2009) |
| |
Method for computing short-range forces driving grain-boundary premelting,
J. J. Hoyt, D. Olmsted, S. Jindal, M. Asta, and A. Karma,
Phys. Rev. E 79, 020601 (2009). |
| |
Atomistic simulations of crystal-melt interfaces in a model binary alloy: Interfacial
free energies, adsorption coefficients and excess entropy, C. A. Becker, D. L. Olmsted,
M. Asta, J. J. Hoyt, and S. M. Foiles,
Phys. Rev. B 79, 0054109 (2009) |
| |
|
2008 |
Atomistic simulation study of the structure and dynamics of a faceted crystal-melt
interface, D. Buta, M. Asta, and J. J. Hoyt,
Phys. Rev. E 78, 031605 (2008) |
| |
Dynamics of grain-boundary motion coupled to shear deformation: An analytical
model and its verification by molecular dynamics,
V. A. Ivanov and Y. Mishin,
Phys. Rev. B 78, 064106 (2008) |
| |
Crystal-melt interfacial free energy of binary hard spheres from capillary fluctuations,
M. Amini and B. B. Laird,
Phys. Rev. B 78, 144112 (2008) |
| |
Phase-field crystal study of grain-boundary premelting,
J. Mellenthin, A. Karma, and M. Plapp,
Phys. Rev. B 78, 184110 (2008) |
| |
Analysis of semi-empirical interatomic potentials appropriate for simulation
of crystalline and liquid Al and Cu,
M. I. Mendelev, M. J. Kramer, C. A. Becker, and M. Asta,
Philos. Mag. 88, 1723 (2008) |
| |
Atomistic simulation of of the effect of Ga on crack tip opening in Al bicrystals,
S. Namilae, B. Radhakrishnan, and J. R. Morris,
Modelling Simul. Mater. Sci. Eng. 16, 075001 (2008) |
| |
Temperature-dependent mechanisms of homogeneous crystal nucleation in quenched
Lennard-Jones liquids: Molecular-dynamics simulations,
L. J. Peng, J. R. Morris, and Y. C. Lo,
Phys. Rev. B 78, 012201 (2008) |
| |
Morphology of epitaxial core-shell nanowires,
H. Wang, M. Upmanyu, and C. V. Ciobanu,
Nano Lett. 8, 4305 (2008) |
| |
Molecular-dynamics study of liquid-metal infiltration during brazing,
E. B. Webb III and J. J. Hoyt,
Acta Mater. 56, 1802 (2008) |
| |
Effects of boundary inclination and boundary type on shear-driven grain-boundary
migration, H. Zhang, D. Du, and D. J. Srolovitz,
Philos. Mag. 88, 243 (2008) |
| |
Using atomistic simulations to inform mesoscale simulations of microstructure evolution,
S. M. Foiles, D. Olmsted, and E. A. Holm,
to appear in MMM2008 (2008) |
| |
|
2007 |
Phase-field crystal modeling of equilibrium bcc-liquid interfaces,
K-A. Wu and A. Karma,
Phys. Rev. B 76, 184107 (2007) |
| |
Lattice stability of aluminum–rare-earth binary systsems,
M. C. Gao, A. D. Rollett, and M. Widom,
Phys. Rev. B 75, 174120 (2007) |
| |
Recent developments and Outstanding Challenges in Theory and Modeling of Liquid Metals,
J. R. Morris, U. Dahlborg and M. Calvo-Dahlborg,
Journal of Non-Crystalline Solids 353, 3444 (2007) |
| |
A Comparison of Crystal-Melt Interfacial Free Energies using Different A1 Potentials,
J. R. Morris, M. I. mendelev and D. J. Srolovitz,
Journal of Non-Crystalline Solids 353, 3565 (2007) |
| |
Dislocation Model for Grain Boundary Stiffness,
M. Upmanyu,
Scripta Mater. 56, 553 (2007) |
| |
Wall-Induced Prefreezing in Hard Spheres: A Thermodynamic Perspective,
B. B. Laird and R. L. Davidchack,
J. Phys. C. 111, 15952 (2007) |
| |
Grain Boundary Interface Roughening Transition and its Effect
on Grain Boundary Mobility for Non-Faceting Boundaries,
D. L. Olmsted, S. M. Foiles, and E. A. Holm,
Scripta Mater. 57, 1161 (2007) |
| |
Molecular Dynamics Study of Equilibrium Concentration Profiles and the Gradient Energy
Coefficient in Cu-Pb Nanodroplets,
J. J. Hoyt,
Phys. Rev. B 76, 094102 (2007) |
| |
Kinetic Coefficient of Steps at the Si(111) Crystal Interface from
Molecular Dynamics Simulations, D. Buta, M. Asta, and J. J. Hoyt,
J. Chem. Phys. 127, 074703 (2007) |
| |
Crystal-Melt Interface Stresses: Atomistic Simulation Calculations for a Lennard-Jones
Binary Alloy, Stillinger-Weber Si, and Embedded-Atom Ni,
C. A. Becker, J. J. Hoyt, D. Buta, and M. Asta,
Phys. Rev. E 75, 061610 (2007) |
| |
Atomistic Underpinnings for Orientation Selection in Alloy Dendritic Growth,
C. A. Becker, D. Olmsted, M. Asta, J. J. Hoyt, and S. M. Foiles
Phys. Rev. Lett. 98, 125701 (2007) |
| |
Molecular Dynamics Calculations of the Crystal-Melt Interfacial Mobility for
Hexagonal Close-Packed Mg, Z. G. Xia, D. Y. Sun, M. Asta, and J. J. Hoyt
Phys. Rev. B 75, 012103 (2007) |
| |
Properties and Determination of the Interface Stiffness, D. Du and H. Zhang
Acta Mater. 55, 467 (2007) |
| |
Molecular Dynamics Simulation of a Ga Penetration Along Grain Boundaries
in Al: A Dislocation Climb Mechanism, H.-S. Nam and D. J. Srolovitz
Phys. Rev. Lett. 99, 025501 (2007) |
| |
Atomic Motion During the Migration of General [001] Tilt Grain Boundaries in Ni,
H. Zhang, D. J. Srolovitz, J. F. Douglas, and J. A. Warren
Acta Mater. 55, 4527 (2007) |
| |
Molecular Dynamics Simulations of Ga Penetration Along Σ5 Symmetric Tilt
Grain Boundaries in an Al Bicrystal, H.-S. Nam and D. J. Srolovitz
Phys. Rev. B 76, 184114 (2007) |
| |
Computer Simulation Combining Finite Difference and Finite Elements Methods:
Solute Drag on Migrating Grain Boundaries in Three Dimension,
M. C. Gao, J. Gruber, A. D. Rollett,and A. P. Kuprat
Materials Science Forum 550, 1075 (2007) |
| |
|
2006 |
Interface mobility from interface random walk, Z. T. Trautt, M. Upmanyu, and A. Karma,
Science 314, 632-635 (2006) |
| |
Kinetic Coefficient for Hard-Sphere Crystal Growth from the Melt,
M. Amini, and B. B. Laird,
Phys. Rev. Lett. 97, 216102 (2006) |
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