Magnetizability and rotational g-tensor at DF-LMP2 level using GIAOs

The program for NMR chemical shifts has been extended to include also magnetizability and rotational g-tensor. This is described in

S. Loibl and M. Schütz, J. Chem. Phys., 141, 024108 (2014).



molpro@molpro.net 2018-09-25