[xcrysden] Problem with 2D charge density maps

Nicholas Dimakis ndimakis at gmail.com
Wed Aug 5 00:49:06 CEST 2009


Hello

I have the following systems,  Pt-CO and PtOs-CO (I replaced 2 Pt atoms with
Os). My calculations are using CRYSTAL06. I was able to plot the 3D maps
(charge differences) with no problems. However I cannot get the 2D maps in a
way that shows blue and red regions similar to the ones shown at
http://www.xcrysden.org/Pictures.html.

Any ideas ?


Thank you



-- 
Nikolaos Dimakis
Assistant Professor
Department of Physics and  Geology
University of Texas-Pan American
1201 W. University Drive Edinburg, TX 78539-2999
Phone: (956) 380-8761
Fax:(956) 381-2423
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