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It seems your questions is more on "How to debug that error" than on the error itself. If you wish me to look into the error specifically, I will do this, I promise :). Otherwise, it is great to learn from your own mistakes and to learn how to debug yourself. The best way to debug a lammps script is to use the command: echo both at the beggining of the ...


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Use pair_table to represent any pairwise potential in the form of a table


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