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Example Computations

The time evolution for 5 different sets of initial data, including comparisons between surface diffusion (SD) and surface attachment limited kinetics (SALK) are illustrated in Figures 3-7. Computations of SD are displayed in a time sequence of light gray images, while images for SALK are in dark gray. The kinetic coefficients in each case have been scaled so that evolution occurs roughly on the same time scale for each.

In Figure 3, is a square. The initial data is an elongated rectangle. Figure 4 begins with the same initial data, but uses a 16-gon as its Wulff shape. Note that in both cases, the particle flowing by SALK remains convex. In contrast, particle flowing by SD becomes non-convex, forming ``bulbs'' on the ends of the initial rectangle. These examples show an important difference between SD and SALK. In SD, motion is so as to reduce local gradients in chemical potential, and this ``proximity effect'' can produce non-convex regions from previously convex ones. In SALK, by contrast, convex regions always will remain convex because there is no local force driving them to become concave.

In Figure 5 the analog of the rectangle has been rotated by . is a square, and so what was a rectangle is now a pair of staircases. Here, not only is the flow different for SALK and SD, but the end configuration as well. For SALK, volume diffuses uniformly to the zero stairsteps from the positive ends causing all the steps not adjacent to the ends to move diagonally as a unit, since equations 16 and 17 imply that all facets with move with the same velocity. In motion by SD, on the other hand, the middle region of the zero steps hardly moves at all. The steps near the end are removed one by one as volume is pumped from the ends towards the center. In fact, the small edges are rapidly moving off down the staircase as described in Section 3.1.1. Eventually, the particle breaks into two particles each of which asymptotically approach . The ability to detect and handle such topological changes is one of the strengths of the general computational scheme. This example further demonstrates how SALK cannot take non-convex curves to convex ones. The staircase in Figure 5 is the crystalline analog to a convex curve in the surface energy sense: it contains no points of negative curvature.

One might wonder if it is possible that stepping might only occur at ``topological times'', as it does in Figures 3 and 4, in which all stepping occurs only at the start of the computation. Figure 6 shows that this is not the case, and that stepping may occur in SD even at regular times. The Wulff shape is again a square, and the initial condition is L-shaped, having one of the branches very elongated. In SD flow, bulbs form on the ends of each branch at time via the proximity effect. Interestingly, another step forms on the inside long edge of the L so as to turn the single long edge into a long zero edge and an edge with negative curvature at the base of the shorter leg of the L. The two legs of the L shrink at approximately the same speed, and so the shorter leg becomes a single bulb before the bulb at the other end of the long leg has time to travel down the leg. Note that as the short leg shrinks, the edge which initially formed the outside of the short leg becomes very short, and runs up the long leg, eventually disappearing. At even later times, the material that was contained in the short leg eventually reforms itself into a large bulb and then motion continues as for the elongated rectangle. It is important to note, however, that a new step formed as the blob on the short leg turned the corner to begin moving down the long leg.

Topological changes may occur in a surprising and complicated manner. The spiral in Figure 7 is an illustrative example for a square . Initially the ends of the spiral have large positive , and the `interior' facets have zero or small . Most of the action takes place at the inner end where and the gradient in is very large. As the inner end unwraps and forms bulbs (a manifestation of the proximity effect), it collides with another part of the crystal forming a hole. The two surfaces then flow independently, until they collide again, re-forming a simply connected domain. The process repeats once: the system approaches an equilibrium with a Wulff-shaped hole in it. Note that the flow does not scale uniformly with . Each of the topological changes produces large discontinuous changes in the chemical potential which reestablish large potential gradients in regions which had previously nearly exhausted them. Thus, the overall effect is that the evolution starts fast and slows until a topological change occurs, and then proceeds rapidly in those regions proximate to the event which caused the topological change.

Although the spiral of Figure 7 did not undergo a topological change under SALK, it is possible to have initial data which does produce topological changes for that type of flow. Figure 8, which uses an octagonal Wulff shape, starts as a large particle with a deep notch cut out of it. Under both flow by SALK and by SD, the notch closes off and the system equilibrates to a Wulff-shaped crystal with a Wulff-shaped hole in it. The reason the flow by SALK is able to produce the topological change is because of the two opposing zero- facets. Because the initial shape is a simply connected solid, the average is positive. Thus all zero curvature facets have the same positive velocity, and so they can be placed so as to collide.



Next: Discussion Up: Shape Evolution by Surface Diffusion and Surface Attachment Limited Kinetics on Completely Faceted Surfaces Previous: Surface Attachment Limited


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