[lammps-users] Decane in LAMMPS

[nahid_khiabani]

Dear Friends

I am simulating Deane. When I increase the number o molecules up to 5000, after minimization the temperature of the system increases alot about 100000 in Real units and then some bonds missing and I give an error about this. Would you please help me about this?

Thanks alot

Nahid

[sjplimp]

Likely, the initial config of your system was bad and it blew
up.

Steve