Dear All,

I have a small question regarding the energy output from the dynamics simulation. As we know:

Total Energy = Potential Energy + Kinetic Energy --------- Eq. (1)

Potential Energy = Valence Energy + Non-bond Energy --------- Eq. (2)

So, I found from the simulation the Non-bond Energy (-64718.1) is higher than the Total Energy (-54854.8). Is it possible to get that scenario?

Thank you in advance,