Update README.md

parent f05f1748
......@@ -4,9 +4,9 @@ obtained as follows:
optimized by using lammps with the tersoff potentials.
2. Then a H atom was inserted in a tetrahedral site into the
optimized W sample.
3.- The sample with a H atoms is energy optimized with lammps and
3. The sample with a H atoms is energy optimized with lammps and
tersoff potentials.
4.- The obtained W-H sample is used to compute the DVs of:
4. The obtained W-H sample is used to compute the DVs of:
* bcc W atom
* H atom in a tetrahedral instersitial site
* W atom as first nearest neighbor to the H atom
......
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