Dear Riya, You can tune these value using their tags which well explained in the manual. As you decrease the energyshift your first orbitals will get larger and vice versa. Slit norm helps you to modify the tail of the second and higher order ZETAs in the atomic orbital's expansion. However, to understand its behavior you need to play with it yourself.
Best regards Mohammad On Sun, May 21, 2017 at 9:40 AM, Riya Rogers <[email protected]> wrote: > Dear All > > How to set energy shift n split norm? > > Also when to change this is default values are ok? > > Thanking you > > Regards > Riya >
