Dear all, I would like to study the interaction between 2 organic molecules (contains O, H, and C atoms). I calculate vdw forces with vdw-df algorithm which should be used rev-pbe pseudopotential but it seems that my results by blyp+vdw-df is better that revpbe+vdw-df.
Can we use blyp pseudopotentials with vdw-df? I really appreciate your help. Zara, Tern uni
