[molpro-user] basis sets

Grant Hill jghill at wsu.edu
Wed Feb 10 21:27:50 GMT 2010


Dear Mahesh,

These basis sets can be downloaded from the Turbomole basis set library (in Molpro format):

http://bases.turbo-forum.com/TURBOMOLE_BASISSET_LIBRARY/tbl.html

HTH,

Grant



On 10 Feb 2010, at 07:35, mahesh kumar wrote:

> Dear Molpro users,
>  
> I would like to use a def2-TZVP basis set for Be, Mg, Zn with its corresponding density fitting basis in Molpro which not included in the Molpro basis set library. Presently I am using molpro 2009.1 version binary code. I would appreciate any help in this regard.
>  
> Regards
> Mahesh 
> 
> 
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