[xcrysden] ***SPAM*** 5.992 Band structure display

Tone Kokalj tone.kokalj at ijs.si
Tue Sep 27 22:15:52 CEST 2011


On Sun, 2011-09-25 at 11:39 +0800, 王舒东 wrote:
> Dear developers:
>  How can I get the band structure in Xcrysden? What file I need if I
> want to get the band structure?

You can get band structure display in xcrysden only with connection to
CRYSTAL program. In this particular case you need to load the crystal's
unit 9. See: http://www.xcrysden.org/doc/crystal.html

and in particular:
http://www.xcrysden.org/doc/crystal.html#__toc__29

Regards,

-- 
Anton Kokalj
J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia 
(tel: +386-1-477-3523 // fax:+386-1-477-3822)

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