[Wien] Data meaning in WIEN2K
Karen tim
karenlpat at gmail.com
Wed May 25 14:13:53 CEST 2011
Dear Stefaan
thank you for your replay*
are there any reference other than the UG
thanks
*
>See section 4.4 of the usersguide and/or explanatory sentences just
>before these labels in the case.scf file.
>Stefaan
>>* can you tell me what :
*>>* DUPxxx
*>>* DTOxxx
*>>* NUPxxx
*>>* NTOxxx
*>>* CUPxxx
*>>* CTOxxx
*>>* FCAxxx
*>>* FGLxxx
*>>* refers to*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110525/42f60866/attachment.htm>
More information about the Wien
mailing list