1 Questions 29 Answers 0 Followers
Questions related from Aleksey E. Kuznetsov
Dear All, can anybody please advise me how to use correctly the GD2 empirical dispersion correction for the B3LYP and CAM-B3LYP functionals? I added the keyword EmpiricalDispersion=GD2 to the...
09 September 2019 8,947 3 View