Examples
Friday, 30 June 2006 14:04
administrator
Elle examples:
 |
 |
 |
| I set up a model in Elle with a horizontal grain size layering, I ran the experiment for 6000 time steps.
Except for the time=6000 stage we can still see some effect of the initial grain size variation.
Figure 1 shows in black just those areas unswept by grain boundaries during the entire experiment.
The inital grain size layering is still apparent as a size variation in these cores. |
| Mark Jessell |
 |
 |
 |
 |
| These simulations couple a grain size and strain dependant viscous rheology with grain
size reduction and grain growth processes. It was found that significant strain localization
occurred only when the grain size dependence of the viscosity was non-linear, and was greatly
enhanced by the activity of the grain size modifying processes. The intensity and
location of the zone of strain localization varied spatially and temporally, with the result
that the finite strain state showed a much broader, and hence less intense, zone of localized
deformation than the instantaneous state. |
| Mark Jessell |
| |
 |
 |
 |
| Evolution of a single melt pocket situated ata triple junction, with a melt-crystal wetting
angle of 180° |
| Mark Jessell |
| |
 |
 |
 |
| Evolution of a single melt pocket situated at a triple junction,
with a melt-crystal wetting angle of 0° |
| Mark Jessell |
| |
 |
 |
 |
| Evolution of a single melt pocket situated ata triple junction, with a melt-crystal
wetting angle of 120° |
| Mark Jessell |
| |
 |
 |
 |
| Simulation of Ostwald Ripening. Ostwald ripening is the process by which larger particles
(or, for emulsions, droplets) grow at the expense of smaller ones due to the higher surface energy and
hence solubility of the smaller particles and to molecular diffusion through the second phase. In this
example the green phase is also undergoing grain growth. |
| Mark Jessell |
| |
 |
 |
 |
Grain growth simulations using the microstructure simulation system Elle have been
performed inmaterials with a pre-existing grain shape foliation. As might be expected, the
foliation is destroyed by the end of the experiment, and grain areas have increased by a factor
of seven. The area of material swept by the migrating grain boundaries was monitored, and it was
found that at every stage, virtually all of the grains which survived the grain growth process
contain one and only one core of unswept material. Remarkably these remnant unswept cores preserve
a useable record of the initial grain size and the orientation of the grain shape foliation. This
work suggests that, even for samples where no equivalent protolith can be found, it may be possible
to see past a grain growth episode to estimate the original grain shape and grain size of the rock,
and perhaps even reconstruct the grain boundary kinematics. In addition the identi?cation of unswept
cores has the potential to help unravel the evolution of grain boundary chemistry in rocks during
metamorphism.
From:The preservation potential of microstructures during static grain
growth |
| M. W. JESSELL, O. KOSTENKO AND B. JAMTVEIT. J. metamorphic Geol., 2003, 21, 481-491 |
| |
 |
 |
 |
| In this experiment the equilibrium melt level is decreased by a small amount each time
step, which simulates crystallisation from the melt. The surface energies are anisotropic so the
crystals tend to develop lath shaped crystals as they grow, until they touch each other, where the
anisotropy of surface energy is significantly lowered, and irrational interfaces result. |
| Mark Jessell |
| |
 |
 |
 |
| These trails might be expected if triple junctions contain a different chemistry,
or if partitioning is different at triple junctions. White lines are grain boundaries, purple lines
track successive positions of triple junctions. Note the rough bilateral symmetry of triple junction
trails that develops when a grain disappears. |
| Mark Jessell |
| |
 |
 |
 |
| This model shows the effects that "mica" caps can have on the kinematic behavior of
a rigid object (a porphyroblast in this case). This model runs to a shear strain of 2.0. In a
homogeneous, viscous material undergoing simple shear, a rigid object with circular cross section
should rotate 57 degrees relative to the instantaneous stretching axes after a shear strain of 2.0.
By assigning different competency contrasts between the matrix and mica caps (the porphyroblasts is
assumed to be rigid), we can achieve rotations between zero and 57 degrees relative to the ISA. This
movie shows zero degrees of rotation! This was done with Elle. Mica caps are continually generated
around rigid objects during deformation through dissolution of soluable phases like quartz and feldspar,
with or without growth of new mica. An important aspect of this movie is that I included manual
"dissolution" to concentrate mica in the cap. If this is not done, the mica flows past the
porphyroblast and the cap diminishes. |
| Scott Johnson |
| |
 |
 |
 |
| Development of grain boundary migration growth bands. Development of remnant unswept
cores during grain growth, after 0, 500, 1000 and 1500 time steps. At each stage of the evolution,
areas never swept by grain boundaries are left green, and areas swept at least once by a migrating
boundary are coloured white. Grain boundaries are shown as black lines. At every stage of the evolution
the vast majority of grains possess a core of unswept material. Some of these cores at each stage are
in contact with the grain boundary network, whereas others are completely isolated from it. |
| Mark Jessell |
| |
 |
 |
 |
| Oscillatory zoning predicted by cyclical grain boundary chemistry variations during
grain growth. Note preferential widening of bands around triple junctions. Figure 1
Pattern after 200 time steps, pattern after 10,000 time steps. Note repeated truncations of the
patterns. |
| Mark Jessell |
 |
 |
 |
 |
| Zoning predicted for grain boundary migration driven by defect energy contrasts.
Oscillatory zoning produced by cyclical grain boundary chemistry variations. Note relatively
uniform band widths. Figure 1 Distribution of defect energy levels in initial model
(red high, blue low). |
| Mark Jessell |
 |
 |
 |
 |
| Zoning predicted for garnet/biotite Fe exchange reactions. In this experiment both
grain boundary and lattice concentrations are shown with the same look up table, (but with different
scaling). The grain boundary concentrations show the gradual loss of Fe from the Biotite, and the
lattice concentrations show the preferential enrichment at garnet grain boundaries, but also the
preferential enrichment around the perimeter of the cluster, and finally the preferential enrichment
where the biotite grains are nearest. Zoning patterns are roughly concentric with respect to current
grain boundaries. Note that this model has cyclic limits, so that the biotite grains are also ?near?
below and to the right of the cluster. Figure 1 Starting model configuration. Garnet grains are
red, biotite grains are yellow, matrix grains are green, grain boundaries are white, and blue dots show
the location of unconnected nodes that store lattice chemistry information. |
| Mark Jessell |
| |
 |
 |
 |
| Numerical simulation of type II subgrain growth ? anisotropic surface energy.
Representation of a combination of the 3 Euler angles in different colour. Grain boundaries
with a lattice misorientation angle above 15° are shown in black. Each picture represents 100
model timesteps. |
| From: S. Piazolo, M. W. Jessell, D. J. Prior, P.D. Bons (submitted J. Microscopy)
The integration of experimental in-situ EBSD observations and numerical simulations: A novel
technique of microstructural process analysis. |
| |
 |
 |
 |
| Simulation of grain boundary diffusion away from the boundaries
of a single grain with a high concentration of a trace element. |
| Mark Jessell |
| |
 |
 |
 |
| In this experiment, the red grains have high dislocation densities and the
blue grains have low values. This is the major driving force for grain boundary migration
in this example. |
| Mark Jessell |
| |
 |
 |
 |
| Elle simulation of Normal Grain Growth, driven by the reduction of grain boundary energy. |
| Mark Jessell |
| |
 |
 |
 |
Grain growth dominated by high surface energy anisotropy, which prevents most
boundaries from moving. Grains whose boundaries which can still move eventually dominate the
microstructure.
Note that even though the starting microstructure is a foam texture,
many of the triple junctions that develop, even in the apparently stable finer grained material, do
NOT evolve to 120°, which would be the equilibrium angle if there was no surface energy anisotropy. |
| Mark Jessell |
| |
 |
 |
 |
| Crystallisation from a single seed. The anisotropy of surface energy eventually
controls the external crystal form. |
| Mark Jessell |
| |
 |
 |
 |
| Simulation evolution of grain shape of a single snowflake as a result of reduction
of surface energy, but no change in overall area. |
Last Updated on Wednesday, 05 July 2006 18:45