TURBOMOLE Users Forum

TURBOMOLE Modules => Define => Topic started by: evgeniy on April 04, 2008, 05:36:10 PM

Title: On the def2-SV(P) basis sets
Post by: evgeniy on April 04, 2008, 05:36:10 PM

Hi Everybody,

I am wondering, whether I get it right that
the def2-SV(P) basis sets are absolutely the same as
the def-SV(P) ones for (at least) all elements of the 1 to
4 rows of the periodic Mendeleev's table. Thanks for
your replys!

Best,
Evgeniy

Title: Re: On the def2-SV(P) basis sets
Post by: Arnim on April 07, 2008, 10:26:25 AM

Hello!

Yes, that's right.
But there are differences for heavier atoms.

Cheers,
Arnim