added my nice sim prec simulation sequence since it gets removed from
authorhackbard <hackbard@sage.physik.uni-augsburg.de>
Wed, 20 Feb 2008 19:02:47 +0000 (20:02 +0100)
committerhackbard <hackbard@sage.physik.uni-augsburg.de>
Wed, 20 Feb 2008 19:02:47 +0000 (20:02 +0100)
talk :p

posic/talks/sic_prec_sim_sequence.tex [new file with mode: 0644]

diff --git a/posic/talks/sic_prec_sim_sequence.tex b/posic/talks/sic_prec_sim_sequence.tex
new file mode 100644 (file)
index 0000000..14d0743
--- /dev/null
@@ -0,0 +1,89 @@
+ \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
+  \rput(7,4.5){\pnode{tc1-h}}
+  \rput(2,4.5){\pnode{tc1-hh}}
+  \rput(4.5,2.5){\pnode{nc-h}}
+  \rput(9,2.5){\pnode{nc-hh}}
+  \rput(9,2){\pnode{tc2-h}}
+  \rput(2,2){\pnode{tc2-hh}}
+  \rput(4.5,0){\pnode{tc3-h}}
+  % direct lines
+  \ncline[]{->}{init}{tc1}
+  \ncline[]{->}{adj1}{tc1}
+  \ncline[]{->}{insert}{nc}
+  \ncline[]{->}{adj2}{tc2}
+  \ncline[]{->}{tc2}{td}
+  \lput*{0}{yes}
+  \ncline[]{->}{td}{tc3}
+  \ncline[]{->}{tc3}{end}
+  \lput*{0}{yes}
+  % lines using help nodes
+  \ncline[]{tc1}{tc1-h}
+  \lput*{0}{yes}
+  \ncline[]{->}{tc1-h}{insert}
+  \ncline[]{tc1}{tc1-hh}
+  \lput*{0}{no}
+  \ncline[]{->}{tc1-hh}{adj1}
+  \ncline[]{nc}{nc-h}
+  \lput*{0}{no}
+  \ncline[]{->}{nc-h}{tc1}
+  \ncline[]{nc}{nc-hh}
+  \ncline[]{-}{nc-hh}{tc2-h}
+  \ncline[]{->}{tc2-h}{tc2}
+  \lput*{0}{yes, {\footnotesize $T_{set}:=450\, ^{\circ}C$}}
+  \ncline[]{tc2}{tc2-hh}
+  \lput*{0}{no}
+  \ncline[]{->}{tc2-hh}{adj2}
+  \ncline[]{tc3}{tc3-h}
+  \lput*{0}{no}
+  \ncline[]{->}{tc3-h}{tc2}
+  % insertion volumes
+  \psframe[fillstyle=solid,fillcolor=white](9.5,1.3)(13.5,5.3)
+  \psframe[fillstyle=solid,fillcolor=lightgray](10,1.8)(13,4.8)
+  \psframe[fillstyle=solid,fillcolor=gray](10.5,2.3)(12.5,4.3)
+  \rput(9.75,3){\pnode{ins1}}
+  \rput(10.25,3.3){\pnode{ins2}}
+  \rput(10.75,3.6){\pnode{ins3}}
+  \ncline[]{-}{insert}{ins1}
+  \ncline[]{-}{insert}{ins2}
+  \ncline[]{-}{insert}{ins3}
+  \psframe[fillstyle=solid,fillcolor=white](9.5,7.6)(13.5,8.1)
+  \psframe[fillstyle=solid,fillcolor=lightgray](9.5,6.8)(13.5,7.3)
+  \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}