bcrowell - i think the shift has been made, cheers.
alxm - thanks for the advise!
Thing is that we are damaging the organic systems and are breaking bonds. The potential used is the Brenner REBO potential...
Guys,
The question is as follows:
Q) I currently simulate organic systems using the Molecular Dynamics (MD) program. Previously, I have used MD to simulate primarily Silicon and Boron interaction at relatively high energies which is fine with the classical approach used with MD. I was...
It is a great story - Welldone G01! Wish you luck in your PhD! Remember, there maybe times when you feel down during your PhD (maybe not), but if you do, cheer up during these times, take a break, finally believe that you have what it takes ! Clearly you have demonstrated it already...