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Re: [sdpd] Seeking for a genius in phase transition/structure prediction

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      <p>Dear Sir,<br>
        If u dontmine i  will try to solve the  problem at Room temperature using the intensity data. <br>
Thanking you<br>
<br>
Yours sincerely,<br>
S.Chandrasekaran,<br>
Research Scholar,<br>
Department of Physics,<br>
Gandhigram Rural Institute, <br>
Gandhigram - 624302<br>
Tamilnadu,<br>
India<br>
<br>
From:<br>
<br>
Armel Le Bail &lt;<a href="mailto:armel.le_bail%40univ-lemans.fr";>armel.le_bail...@univ-lemans.fr</a>&gt;<br>
<br>
To:<br>
<br>
<a href="mailto:sdpd%40yahoogroups.com";>sdpd...@yahoogroups.com</a><br>
<br>
Date:<br>
<br>
01/05/2011 03:08 AM<br>
<br>
Subject:<br>
<br>
[sdpd] Seeking for a genius in phase transition/structure prediction<br>
<br>
Sent by:<br>
<br>
<a href="mailto:sdpd%40yahoogroups.com";>sdpd...@yahoogroups.com</a><br>
<br>
Hi,<br>
<br>
Here is the problem :<br>
<br>
Inorganic phase containing K/P/O.<br>
<br>
Crystal structure determined by SDPD at 300°C.<br>
<br>
Phase transition at 270°C, powder diffraction diagrams available<br>
<br>
from room temperatute to 700°C. But indexing at room temperature<br>
<br>
failed (this is conventional X-ray, low resolution).<br>
<br>
Then, there could be two possibilities, either recording a high<br>
<br>
resolution powder pattern, or predicting the low temperature phase.<br>
<br>
Any expert in phase transition wanting to attempt to solve that problem ?<br>
<br>
Best regards,<br>
<br>
Armel Le Bail<br>
<br>
(happy New Year to the SDPD mailing list subscribers)<br>
<br>
[Non-text portions of this message have been removed]<br>
<br>
[Non-text portions of this message have been removed]<br>
<br>
</p>

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