Hi,
I am using GULP (command based) software to study Molecular Dynamics simulation of Nanoclusters. I want to keep constant heating rate. How I can set up it?
Is it Temp/(time step or equilibration time )?
Hi,
I am using GULP (command based) software to study Molecular Dynamics simulation of Nanoclusters. I want to keep constant heating rate. How I can set up it?
Is it Temp/(time step or equilibration time )?