>Instead,
I adopted the restraint/constraint system as soon as some
>distances
went stranges.
>Yes,
fear, fear to be personnally attacked again that way.
For me
restraints are much more frightful ;-(:
http://www.google.com/search?q=restraints
While for
some sort of people they may be thrilling.
*******************************************************
Leonid A. Solovyov
Institute of Chemistry and Chemical Technology
660049, K. Marx 42, Krasnoyarsk, Russia
http://sites.google.com/site/solovyovleonid
*******************************************************
________________________________
From: xtal <x...@noos.fr>
To: s...@yahoogroups.com
Sent: Thursday, August 1, 2013 1:56 AM
Subject: Re: [SPAM] Re: [sdpd] Re: Are restraints as good as observations ?
>Off topic : what are you afraid of ? Excuse me, but why do you use words
>like fear ? I do not understand. Lubo
The first time some of my Le Mans "colleagues," physicists, took one of my
SDPDs
(was beta-Ba3AlF9) and published a DFTiization of it, saying that powder
diffraction
is close to be shit was not especially funny for me. My original paper said
that the Al-F
distances were certainly not accurate, no restraints were appled. The
physicists were
proud of their extraordinary success, prooving how powder diffraction
results could be
wrong and the information was well distributed in all parts of the lab.
Then I stopped
to deliver raw Rietveld refinement results, and stopped to say that, you
know, this is
powder, the ratio of refined parameters/hkl is high, do not expect any
accuracy, et(c.
Instead, I adopted the restraint/constraint system as soon as some
distances went
stranges.
Yes, fear, fear to be personnally attacked again that way.
Better to have ennemies than such "colleagues".
Best,
Armel
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