Use this: http://vergil.chemistry.gatech.edu/notes/cp.pdf
Mahmoud On Sep 24, 2013, at 3:23, "Hamidreza Balangi" <[email protected]<mailto:[email protected]>> wrote: hi Please about The Basis Set Superposition Error (BSSE) when Adsorption occurs molecules on graphene sheet, guide me how to solve it. This error caused an unusual increase in the absorbed energy is siesta. Regards. hamidreza balangi
