Commit 3f511f76 authored by COULAUD Olivier's avatar COULAUD Olivier

add how we construct DL_POLY file

parent 2505fa98
......@@ -421,7 +421,7 @@ Force &$C_{force}$& -138935.4835 & $10\,J mol^{-1}\, \AA^{-1}$\\
The force unit is the internal DL\_Poly unit.
The first test consists in a small crystal $4\times 4\times 4$ of NaCl. It is composed of 128 atoms The second tests is a larger crystal $10\times 10\times 10$ of NaCl and have X atoms.
The first test consists in a small crystal $4\times 4\times 4$ of NaCl. It is composed of 128 atoms The second tests is a larger crystal $10\times 10\times 10$ of NaCl and have 2000 atoms. The positions and the forces are stored in the \texttt{REVCON} file and the energy in the \texttt{STATIS} file.
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\section{Conclusion}
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