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<p class="MsoNormal">Thank you very much for the reply. <o:p></o:p></p>
<p class="MsoNormal"> As for your suggestion, I tried ibrav =14 using same celldm(1,2,3,4,5,6) with 4 and 5 equal to zero. But it did not work(“Error in routine thermo_setup (1):internal path not available”). Could you try to tell me what I did wrong? How
do you implement it manually because I tried but not sure if manually has a different meaning. Could you show me how?<o:p></o:p></p>
<p class="MsoNormal">Thank you and looking forward to your reply.<o:p></o:p></p>
<p class="MsoNormal">EL-abed<o:p></o:p></p>
<p class="MsoNormal"><span style="font-size:12.0pt;font-family:"Times New Roman",serif">El-abed Haidar</span><span style="font-size:14.0pt;font-family:"Times New Roman",serif">
</span><span style="font-size:10.0pt;font-family:"Times New Roman",serif">| <span style="color:#333333">Doctor of Philosophy</span> (Science)</span><br>
<span style="font-size:10.0pt;font-family:"Times New Roman",serif"> <span style="color:#333333">Condensed Matter Theory (CMT) Group</span>| School of Physics</span><br>
<span style="font-size:10.0pt;font-family:"Times New Roman",serif"> THE UNIVERSITY OF SYDNEY | NSW | 2006</span><o:p></o:p></p>
<p class="MsoNormal"><o:p> </o:p></p>
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