Commit 6eef1680 authored by Riello, Massimo (mriello)'s avatar Riello, Massimo (mriello)
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Update README.md

parent 8147a56c
......@@ -26,3 +26,10 @@ LAMMPS input/output files can be parsed with:
## Test Files
Example input/output files of LAMMPS can be found in the directory test/examples.
- /methane/ : NVT simulation on pure CH4 with different logging styles (see input file name)
- /methane_MD_traj/ : NVT simulation on pure CH4 with different trajectory styles (see input file name)
- /hexane_cyclohexane/ : NVT simulation on a binary (equimolar mixture)
- /1_methyl_naphthalene/ : NVT simualtion on pure 1-methylnaphthalene (no trajectory)
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