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Re: [SPAM] Re: [sdpd] Re: Are restraints as good as observations ?
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<p><br>
>Off topic : what are you afraid of ? Excuse me, but why do you use words <br>
>like fear ? I do not understand. Lubo<br>
<br>
The first time some of my Le Mans "colleagues," physicists, took one of my <br>
SDPDs<br>
(was beta-Ba3AlF9) and published a DFTiization of it, saying that powder <br>
diffraction<br>
is close to be shit was not especially funny for me. My original paper said <br>
that the Al-F<br>
distances were certainly not accurate, no restraints were appled. The <br>
physicists were<br>
proud of their extraordinary success, prooving how powder diffraction <br>
results could be<br>
wrong and the information was well distributed in all parts of the lab. <br>
Then I stopped<br>
to deliver raw Rietveld refinement results, and stopped to say that, you <br>
know, this is<br>
powder, the ratio of refined parameters/hkl is high, do not expect any <br>
accuracy, et(c.<br>
Instead, I adopted the restraint/constraint system as soon as some <br>
distances went<br>
stranges.<br>
<br>
Yes, fear, fear to be personnally attacked again that way.<br>
<br>
Better to have ennemies than such "colleagues".<br>
<br>
Best,<br>
<br>
Armel<br>
<br>
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