Next: Travelling wave solutions Up: No Title Previous: Introduction

A phase field approach

We use a diffuse-interface model with an order parameter and a concentration as the only field variables. Moreover, the interface we consider is straight and represents a boundary between two grains of the same phase. In particular, we exclude at the outset any influence that curvature of the boundary or temperature variation may have on the motion. In reality, these boundaries are usually curved; that additional effect has just not as yet been included in our model.

Typically, the concentration could represent the fraction of available lattice sites which are filled by solute atoms, and so we shall take its range to be the interval . Similarly , the two extremes representing the two perfect grains on either side.

As is usual with diffuse-interface models (e.g. [2]), the postulated evolution system can be understood as a gradient flow with respect to a functional. In this case, the functional is appropriately named the free energy , since temperature will be constant. It has contributions coming individually from and , plus a small contribution resulting from the interaction between the two fields:

The first term will be of standard van der Waals-Cahn-Hilliard form

Here is the domain in space occupied by the solid material. Rather, assuming everything is independent of one space coordinate, we take it to be the strip , representing a 2D cross section of the metal film. The grain boundary will be a subregion of consisting of a slim rectangle bounded on top and bottom by the two faces . The law of motion of this rectangle is our primary object of interest. The parameter is some measure of the relative weight attached to gradients of in the expression for the free energy (we shall see that is also a measure of the thickness of the interface ), and is approximately the free energy density if were constant in space. We take it to be the following double-well potential with barrier at (see, e.g. [1]):

For the values is left undefined.

We take

where is a convex function representing the free energy density of the solid due to the presence of the solute. A typical form for is

Other effects of the type we are seeking can be obtained by including terms involving in (4); we shall omit them for simplicity.

Our object will be to discover interaction terms which can serve as impetus for the motion of the interface and which have physical interpretations. They will be of the assumed form

The small dimensionless normalizing parameter is chosen so that the derivatives of are of order unity. Setting , we assume the smallness relations

Our chosen kinetic equations take the form

(the error term depends on and will not be given explicitly), where represents the diffusivity of the solute as a function of the degree (measured by ) to which the material is ordered, and is a relaxation time.

One interpretation and/or derivation of the system (8) involves its characterization as a gradient (steepest descent) flow for the functional with respect to a certain -dependent scalar product, at least in the case that and is given by (5).

We are mostly interested, however, in the case when vanishes in much of the domain of interest; the gradient nature of the flow then degenerates. It is well known, in fact, that the diffusivity is much larger in the grain boundary than in a perfect crystal. We shall make the simplifying assumption that in the crystals, that is when . Our specific choice for is

where is a constant.

By the choice (3) of , the system (8) now becomes

To account for the possibility that , we extend (10) as a variational inequality (see [1] for an analogous situation). The result is that in places where , (10) need not hold; all that is necessary there is for and its gradient to be continuous.

As boundary conditions on , physical considerations suggest that

where denotes differentiation in the direction normal to , and (neglecting )

where is a given value depending on the properties of the external vapor.

Conditions at are also needed. We require

in regions to the left and right in our strip domain where the pure crystals reside, i.e. where . These regions are not known at the outset.



Next: Travelling wave solutions Up: No Title Previous: Introduction


[email protected]
Fri May 26 15:25:12 EDT 1995