Hi LAMMPS Users:
I came across a weird problem about energy minimization in LAMMPS. For a polymer model I built, I did a energy minimization without saving restart files. Then I decided to re-do it and save restart files for subsequent calculations. It turns out the results of the two minimization were not same. At first I thought there might be randomization in the minimization. But after more tests, I found that all calculations without saving restart files had the same output while all those saving restart files having the same result. It seems that saving restart files is affecting calculation, although it’s hard believe for me. Can someone please take a look at this issue? The data file is big so I didn’t attach it here. If you want to do a test, the data file is available upon asking. Below I paste the input file: