[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]
Re: [sdpd] Fullprof
Lubomir Smrcok schrieb:
> Use a bunch of restraintes on the distances.
>
It is my experience that this does not work in praxis. For flat groups
the changes in distance are a cos-function of the planar angles. Even
with very strict distance restraints quite large planar angles will
occur. Planar restrains are the feature I miss most in the current
Fullprof. The soft-options of the rigid-body module should be able to do
the trick. But it seems to be nigh impossible to transfer a structure
into this format.
>
> On Fri, 13 Feb 2009, [iso-8859-1] José Miguel Galiana wrote:
>
>> Dear All,
>> Is there any way to put a planar restraint in Fullprof?
>>
>> Thank you very much.
>>
--
***********************************************************************
Daniel M. Többens Tel.: +43 512 507-5532
Institut für Mineralogie und Petrographie Fax : +43 512 507-2926
Universität Innsbruck
Innrain 52, Bruno-Sander-Haus
A-6020 Innsbruck, Österreich
***********************************************************************
------------------------------------
Yahoo! Groups Links
<*> To visit your group on the web, go to:
http://groups.yahoo.com/group/sdpd/
<*> Your email settings:
Individual Email | Traditional
<*> To change settings online go to:
http://groups.yahoo.com/group/sdpd/join
(Yahoo! ID required)
<*> To change settings via email:
mailto:sdpd-digest...@yahoogroups.com
mailto:sdpd-fullfeatured...@yahoogroups.com
<*> To unsubscribe from this group, send an email to:
sdpd-unsubscribe...@yahoogroups.com
<*> Your use of Yahoo! Groups is subject to:
http://docs.yahoo.com/info/terms/