Center for Scientific Computation And Mathematical Modeling

Two nonlinear diffusion equations for thin film epitaxy, with or without slope selection, are studied in this work. The nonlinearity models the Ehrlich–Schwoebel effect – the kinetic asymmetry in attachment and detachment of adatoms to and from terrace boundaries. Both perturbation analysis and numerical simulation are presented to show that such an atomistic effect is the origin of a nonlinear morphological instability, in a rough-smooth-rough pattern, that has been experimentally observed as transient in an early stage of epitaxial growth on rough surfaces. Initial-boundary-value problems for both equations are proven to be well-posed, and the solution regularity is also obtained. Galerkin spectral approximations are studied to provide both a priori bounds for proving the well-posedness and numerical schemes for simulation. Numerical results are presented to confirm part of the analysis and to explore the difference between the two models on coarsening dynamics.

[1]  Krug,et al.  Surface diffusion currents and the universality classes of growth. , 1993, Physical review letters.

[2]  G. Vojta,et al.  Fractal Concepts in Surface Growth , 1996 .

[3]  Paul Shewmon,et al.  Diffusion in Solids , 2016 .

[4]  Politi,et al.  Ehrlich-Schwoebel instability in molecular-beam epitaxy: A minimal model. , 1996, Physical review. B, Condensed matter.

[5]  J. Villain Continuum models of crystal growth from atomic beams with and without desorption , 1991 .

[6]  T. Einstein,et al.  Unified view of step-edge kinetics and fluctuations , 1998 .

[7]  A. D. Le Claire,et al.  Diffusion in Solids, Liquids, Gases. , 1952 .

[8]  Yoshikazu Giga,et al.  A mathematical problem related to the physical theory of liquid crystal configurations , 1987 .

[9]  Richard S. Falk,et al.  Stability of cylindrical bodies in the theory of surface diffusion , 1995 .

[10]  Hantaek Bae Navier-Stokes equations , 1992 .

[11]  Robert V. Kohn,et al.  Upper bound on the coarsening rate for an epitaxial growth model , 2003 .

[12]  Sander,et al.  Stable and unstable growth in molecular beam epitaxy. , 1994, Physical review letters.

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

[14]  Michael Ortiz,et al.  A continuum model of kinetic roughening and coarsening in thin films , 1999 .

[15]  J. Simon Compact sets in the spaceLp(O,T; B) , 1986 .

[16]  M. Ortiz,et al.  Delamination of Compressed Thin Films , 1997 .

[17]  F. Hudda,et al.  Atomic View of Surface Self‐Diffusion: Tungsten on Tungsten , 1966 .

[18]  R. D. James,et al.  Proposed experimental tests of a theory of fine microstructure and the two-well problem , 1992, Philosophical Transactions of the Royal Society of London. Series A: Physical and Engineering Sciences.

[19]  Conyers Herring,et al.  Surface Tension as a Motivation for Sintering , 1999 .

[20]  J. E. Hilliard,et al.  Free Energy of a Nonuniform System. I. Interfacial Free Energy , 1958 .

[21]  D. Moldovan,et al.  Interfacial coarsening dynamics in epitaxial growth with slope selection , 2000, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.

[22]  J. Villain,et al.  Physics of crystal growth , 1998 .

[23]  J. Howell,et al.  Diffusion in Solids , 1984, Materials Science Forum.

[24]  Oliver Stein,et al.  A fourth-order parabolic equation modeling epitaxial thin film growth , 2003 .

[25]  Richard L. Schwoebel,et al.  Step Motion on Crystal Surfaces. II , 1966 .

[26]  G. M.,et al.  Partial Differential Equations I , 2023, Applied Mathematical Sciences.

[27]  Alain Marty,et al.  Instabilities in crystal growth by atomic or molecular beams , 2000 .

[28]  Jacques Simeon,et al.  Compact Sets in the Space L~(O, , 2005 .

[29]  Christian Ratsch,et al.  Unstable Growth on Rough Surfaces , 1998 .

[30]  Leonardo Golubović,et al.  Interfacial Coarsening in Epitaxial Growth Models without Slope Selection , 1997 .

[31]  Robert V. Kohn,et al.  Singular Perturbation and the Energy of Folds , 2000, J. Nonlinear Sci..

[32]  D. Wolf,et al.  Equilibrium step dynamics on vicinal surfaces , 1993 .

[33]  Robert V. Kohn,et al.  Surface energy and microstructure in coherent phase transitions , 1994 .

[34]  E. Müller,et al.  The Use of Classical Macroscopic Concepts in Surface Energy Problems , 1953 .

[35]  R. Schwoebel Step motion on crystal surfaces , 1968 .

[36]  Zangwill,et al.  Morphological instability of a terrace edge during step-flow growth. , 1990, Physical review. B, Condensed matter.

[37]  W. Mullins Theory of Thermal Grooving , 1957 .