[Wien] AIM: Laplacian ?

Georg Eickerling georg.eickerling at physik.uni-augsburg.de
Fri Nov 28 11:14:27 CET 2003


Dear WIEN users,

I know that the laplacian is being calculated in the AIM-part of WIEN when 
doing a BCP search/characterization. 
I would like to know if it is possible to obtain the Laplacian of the electron 
density from a WIEN-calculation in form of a grid-file or any other format. 

Thank you in advance for any help....

Georg Eickerling


 
============================
Dipl.-Chem. Georg Eickerling
Universität Augsburg
Institut für Physik
Lehrstuhl für Chemische Physik und Materialwissenschaften
Universitätsstr. 1
86159 Augsburg

Phone:	+49-821-598-3358
FAX:		+49-821-598-3227
E-Mail:	georg.eickerling at physik.uni-augsburg.de
WWW:       http://www.physik.uni-augsburg.de/cpm/
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