Dear all,
I'm doing some DFT calculations for a complex system composed of SWNT and porphyrin using Gaussian 09 package, however I succeed to calculate the binding energy of my system, but the value seems too large i.e. - 5.8 eV
So, I read that this value can be corrected if I consider basis set superposition error (BSSE), but I don't know how to calculate the corrected binding energy using that method, especially I'm not that expert one in DFT calculations !
So, any suggestion would be highly appreciated
Thanks in advance
Best Regards,
Ahmed