How to calculate BSSE error in free binding energy for hydrogen bonded systems with weak Hydrogen bonds?

Greetings, I recently started computations on hydrogen bonded systems using B3LYP/6-311++G(2d,2p). I know that for binding energy/interaction energy, ∆E, the Bsse of an AB system is given by...

03 March 2017 8,751 13 View