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pair_comb2.tex
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Wed, Dec 25, 16:46
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text/x-tex
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Fri, Dec 27, 16:46 (1 d, 23 h)
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rLAMMPS lammps
pair_comb2.tex
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\documentclass
[10pt]
{
article
}
\begin
{
document
}
\begin
{
table
}
[h]
\begin
{
tabular
}{
|c|c|c|c|c|c|c|c|c|
}
\hline
&
$
O
$
&
$
Cu
$
&
$
N
$
&
$
C
$
&
$
H
$
&
$
Ti
$
&
$
Zn
$
&
$
Zr
$
\\
\hline
$
O
$
&
F
&
F
&
F
&
F
&
F
&
F
&
F
&
F
\\
\hline
$
Cu
$
&
F
&
F
&
P
&
F
&
F
&
P
&
F
&
P
\\
\hline
$
N
$
&
F
&
P
&
F
&
M
&
F
&
P
&
P
&
P
\\
\hline
$
C
$
&
F
&
F
&
M
&
F
&
F
&
M
&
M
&
M
\\
\hline
$
H
$
&
F
&
F
&
F
&
F
&
F
&
M
&
M
&
F
\\
\hline
$
Ti
$
&
F
&
P
&
P
&
M
&
M
&
F
&
P
&
P
\\
\hline
$
Zn
$
&
F
&
F
&
P
&
M
&
M
&
P
&
F
&
P
\\
\hline
$
Zr
$
&
F
&
P
&
P
&
M
&
F
&
P
&
P
&
F
\\
\hline
\multicolumn
{
9
}{
l
}{
F: Fully optimized
}
\\
\multicolumn
{
9
}{
l
}{
M: Only optimized for dimer molecule
}
\\
\multicolumn
{
9
}{
l
}{
P: in Progress but have it from mixing rule
}
\\
\end
{
tabular
}
\end
{
table
}
\end
{
document
}
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