Iron catalytic nanoparticle formation

ME574(W13) TEAM 4

 

 

 

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Introduction

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Modeling

Result

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       Result

 

With the matlab code, we changed experiment condition such as annealing temperature and initial thickness of thin film.

 

1)  Here is the formation of Iron particle at 800 C from 1nm thick film.

 

Click for Animation

 

Inside the animation, the curve shows x-y coordination (1nm scale) of each node. Each frame (0.15 sec) presents one time step (dt*=10-3) of simulation and we consider that the formation of iron particle is completed when the sum square of x-y coordination changes of all nodes are less than 10-8.

 

 

 

2)  This curve shows the running time to complete the formation depending on the different annealing  temperature.

 

The running time of particle formation is exponentially decreased as the temperature increases in the range of 750 C to 800 C. 

Note that the formation at 750 C has not converged to the circle although the “Change” value is less than 10-8. Therefore we set this value as 10-9 in this case. This modification is reasonable because the surface moves significantly slow in the lower temperature region. 

 

Click for animation (at 750 C), x5 speed.

 

Click for animation (at 850 C), x1 speed.

 

 

 

3)  The following animation shows the iron particle formation depending on the different initial thickness of film layer; 2nm and 3nm.  (The animation is fast-forwarded with 10x speed)

 

Click for animation (2nm thick film)

 

Click for animation (3nm thick film)

 

Regardless of the initial thickness, the final surface has converged to the quadrant which has the final radius according to the conservation of volume as follow;

 

   < Initial shape with 1nm thick film>                <Final shape after annealing, R ~ 1.13 nm >

 

< Initial shape with 2nm thick film>               <Final shape after annealing, R ~ 1.59 nm>

 

  < Initial shape with 3nm thick film>                <Final shape after annealing, R ~ 1.95 nm >