Phase-field model of island growth in epitaxy.

Nucleation and growth of islands in epitaxy is simulated using a continuum phase-field model. In addition to local density of adatoms, a local phase-field variable, varying in the real space, is introduced to describe the epitaxial islands. Evolution of this phase field is determined by a time-dependent Ginzburg-Landau-like equation coupled to a diffusive transport equation of adatoms. When applied to nucleation and growth of islands in the submonolayer regime, this model reproduces both the scaling laws of island density and experimental size and spatial distributions of islands. For island growth in the multilayer regime, this phase-field model reproduces mound structures consistent with experimental images concerned. Accurate coarsening and roughening exponents of the mounds are obtained in this model. Compared with atomic models and mean-field models, this model can provide a fine visualized morphology of islands at large space and time scales of practical engineering interests.

[1]  David Williams,et al.  Instabilities in MBE growth , 1994 .

[2]  A. Mullis Effect of the ratio of solid to liquid conductivity on the stability parameter of dendrites within a phase-field model of solidification. , 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

[3]  Tsui,et al.  Morphology transition and layer-by-layer growth of Rh(111). , 1996, Physical review letters.

[4]  Stroscio,et al.  Scaling of diffusion-mediated island growth in iron-on-iron homoepitaxy. , 1994, Physical review. B, Condensed matter.

[5]  M. Plischke,et al.  Slope selection and coarsening in molecular beam epitaxy. , 1994, Physical review letters.

[6]  Mario Castro,et al.  Phase-field approach to heterogeneous nucleation , 2003 .

[7]  Ernst,et al.  Observation of a growth instability during low temperature molecular beam epitaxy. , 1994, Physical review letters.

[8]  Sander,et al.  Coarsening of Unstable Surface Features during Fe(001) Homoepitaxy. , 1995, Physical review letters.

[9]  Stephens,et al.  Temperature and orientation dependence of kinetic roughening during homoepitaxy: A quantitative x-ray-scattering study of Ag. , 1996, Physical review. B, Condensed matter.

[10]  Alain Karma,et al.  Spiral Surface Growth without Desorption , 1998, cond-mat/9809358.

[11]  A. Karma Phase-field formulation for quantitative modeling of alloy solidification. , 2001, Physical review letters.

[12]  T. Pusztai,et al.  Nucleation and bulk crystallization in binary phase field theory. , 2002, Physical review letters.

[13]  J. Wendelken,et al.  EVOLUTION OF MOUND MORPHOLOGY IN REVERSIBLE HOMOEPITAXY ON CU(100) , 1997 .

[14]  Sharp interface limit of a phase-field model of crystal grains. , 2000, Physical review. E, Statistical, nonlinear, and soft matter physics.

[15]  Stroscio,et al.  Homoepitaxial growth of iron and a real space view of reflection-high-energy-electron diffraction. , 1993, Physical review letters.

[16]  W. K. Burton,et al.  The growth of crystals and the equilibrium structure of their surfaces , 1951, Philosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences.

[17]  R. Folch,et al.  Towards a quantitative phase-field model of two-phase solidification. , 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

[18]  T. Michely,et al.  No coarsening in Pt(111) homoepitaxy , 1999 .

[19]  Geoffrey B. McFadden,et al.  Solute trapping and solute drag in a phase-field model of rapid solidification , 1998 .

[20]  R. Caflisch,et al.  Level-set method for island dynamics in epitaxial growth , 2002 .

[21]  Evans,et al.  Using temperature to tune film roughness: nonintuitive behavior in a simple system , 2000, Physical review letters.

[22]  O Pierre-Louis,et al.  Phase field models for step flow. , 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

[23]  Britta Nestler,et al.  Phase-field model for solidification of a monotectic alloy with convection , 2000 .

[24]  Karma,et al.  Numerical Simulation of Three-Dimensional Dendritic Growth. , 1996, Physical review letters.

[25]  R. Kobayashi Modeling and numerical simulations of dendritic crystal growth , 1993 .

[26]  Evans,et al.  Transition to Multilayer Kinetic Roughening for Metal (100) Homoepitaxy. , 1995, Physical review letters.

[27]  Frédéric Gibou,et al.  Rate equations and capture numbers with implicit islands correlations , 2001 .

[28]  Liu,et al.  Stability and kinetics of step motion on crystal surfaces. , 1994, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.

[29]  James W. Evans,et al.  Development and ordering of mounds during metal(100) homoepitaxy , 2002 .

[30]  D. Chopp A Level-Set Method for Simulating Island Coarsening , 2000 .

[31]  S. Osher,et al.  Level-set methods for the simulation of epitaxial phenomena , 1998 .

[32]  Massimo Conti,et al.  Phase ordering with a global conservation law: Ostwald ripening and coalescence. , 2002, Physical review. E, Statistical, nonlinear, and soft matter physics.