[xcrysden] About display contours of charge density

Chenpeng Zang ppzang at gmail.com
Fri Dec 4 05:11:45 CET 2009


Thank you!
It seems that I should learn how to use it.
So, there is no way to do such things in XCRYSDEN?

2009/12/4 陈伟槟 <bingmou2004 at gmail.com>

> why don't you try lev00? It is quite easy to get the contours of charge on
> certain plane in lev00.
>
> 2009/12/4 Chenpeng Zang <ppzang at gmail.com>
>
>>  I want to display the  contours of charge density on certain plane with
>> XCrysDen. While it is quite successful to display that on the three basal
>> planes, I cannot find a way to display charge density on other planes. For
>> example, if I am interested in charge density on the plane [1,1,1], what can
>> I do?
>> I got my data from vasp with CHGCAR file, and use v2xsf to translate it
>> into the xsf form.
>>
>> _______________________________________________
>> XCrySDen mailing list
>> XCrySDen at democritos.it
>> http://www.democritos.it/mailman/listinfo/xcrysden
>>
>>
>
>
> --
> 陈伟槟
> Chen Weibing
> 中科院半导体研究所超晶格国家实验室
> The State Key Laboratory for Superlattices and Microstructures
> Institute of Semiconductor, Chinese Academy of Science
>
>
> _______________________________________________
> XCrySDen mailing list
> XCrySDen at democritos.it
> http://www.democritos.it/mailman/listinfo/xcrysden
>
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/xcrysden/attachments/20091204/3aab31e0/attachment.htm 


More information about the XCrySDen mailing list