-\begin{slide}
-
- {\large\bf
- Simulation details
- }
-
- \small
-
- SiC precipitation experiments:
-
- \begin{pspicture}(0,0)(12,8)
- % nodes
- \rput(4.5,6.5){\rnode{init}{\psframebox{\parbox{7cm}{
- \begin{itemize}
- \item Initial configuration: $31\times31\times31$ unit cells Si
- \item Periodic boundary conditions
- \item $T=450\, ^{\circ}C$
- \item Equilibration of $E_{kin}$ and $E_{pot}$ for $600\, fs$
- \end{itemize}
- }}}}
- \rput(4.5,4.5){\rnode{tc1}{\psframebox[fillstyle=solid,fillcolor=red]{
- $T=450\pm 1\, ^{\circ}C$}}}
- \rput(7,3.5){\rnode{insert}{\psframebox[fillstyle=solid,fillcolor=red]{
- \parbox{3cm}{
- Insertion of 10 atoms\\
- at random positions}}}}
- \rput(2,3.5){\rnode{adj1}{\psframebox[fillstyle=solid,fillcolor=red]{
- \parbox{3.5cm}{
- Adjusting temperature\\
- for another $100\, fs$}}}}
- \rput(7,2.5){\rnode{nc}{\psframebox[fillstyle=solid,fillcolor=red]{
- $N_{atoms}=6000$}}}
- \rput(4.5,2){\rnode{tc2}{\psframebox[fillstyle=solid,fillcolor=cyan]{
- $T=T_{set}$}}}
- \rput(7,1){\rnode{td}{\psframebox[fillstyle=solid,fillcolor=cyan]{
- $T_{set}:=T_{set}-1\, ^{\circ}C$}}}
- \rput(2,1){\rnode{adj2}{\psframebox[fillstyle=solid,fillcolor=cyan]{
- \parbox{3.5cm}{
- Adjusting temperature\\
- for another $50\, fs$}}}}
- \rput(7,0){\rnode{tc3}{\psframebox[fillstyle=solid,fillcolor=cyan]{
- $T_{set}=20\, ^{\circ}C$}}}
- \rput(10,0){\rnode{end}{\psframebox{End}}}
- % help nodes
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- \rput(2,4.5){\pnode{tc1-hh}}
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- \rput(2,2){\pnode{tc2-hh}}
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- \lput*{0}{yes}
- \ncline[]{->}{td}{tc3}
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- \lput*{0}{yes}
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- \lput*{0}{yes}
- \ncline[]{->}{tc1-h}{insert}
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- \lput*{0}{no}
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- \ncline[]{nc}{nc-hh}
- \ncline[]{-}{nc-hh}{tc2-h}
- \ncline[]{->}{tc2-h}{tc2}
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- \lput*{0}{no}
- \ncline[]{->}{tc2-hh}{adj2}
- \ncline[]{tc3}{tc3-h}
- \lput*{0}{no}
- \ncline[]{->}{tc3-h}{tc2}
- % insertion volumes
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- \psframe[fillstyle=solid,fillcolor=lightgray](10,1.8)(13,4.8)
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- \rput(10.75,3.6){\pnode{ins3}}
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- \ncline[]{-}{insert}{ins2}
- \ncline[]{-}{insert}{ins3}
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- \psframe[fillstyle=solid,fillcolor=gray](9.5,6)(13.5,6.5)
- \rput(11.5,7.85){{\tiny Simulation volume:
- $31\times31\times31\, a^3_{Si}$}}
- \rput(11.5,7.05){{\tiny Volume of minimal SiC precipitation}}
- \rput(11.5,6.25){{\tiny Volume of necessary amount of Si}}
- \end{pspicture}
-
-\end{slide}
-