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<div dir="auto">Many thanks. I have make it. The license of ifort was expired.</div>
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<div id="x_composer_signature" dir="auto">Best regards,
<div>LIANG Xiongyi</div>
<div>Department of Materials Science and Engineering</div>
<div>City University of Hongkong </div>
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<div>-------- Original message --------</div>
<div>From: Lorenzo Paulatto <paulatz@gmail.com> </div>
<div>Date: 13/10/2020 14:53 (GMT+08:00) </div>
<div>To: users@lists.quantum-espresso.org </div>
<div>Subject: Re: [QE-users] Error in ph.x </div>
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<div class="PlainText">You can compile qe 6.6 in exactly the same way as 6.3. If someone else
<br>
did it for you ask him/her for help.<br>
<br>
kind regards<br>
<br>
On 10/13/20 5:43 AM, LEUNG Clarence wrote:<br>
> I also have mpiifor:<br>
> <br>
> which mpiifort<br>
> <br>
> /opt/intel/compilers_and_libraries_2017.1.132/linux/mpi/intel64/bin/mpiifort<br>
> <br>
> Thanks!<br>
> <br>
> Best regards,<br>
> <br>
> LIANG Xiongyi<br>
> <br>
> Postdoctoral Fellow<br>
> <br>
> City University of Hong Kong<br>
> <br>
> *From: *LEUNG Clarence <<a href="mailto:liangxy123@hotmail.com">mailto:liangxy123@hotmail.com</a>><br>
> *Sent: *2020年10月13日11:29<br>
> *To: *Quantum ESPRESSO users Forum <<a href="mailto:users@lists.quantum-espresso.org">mailto:users@lists.quantum-espresso.org</a>><br>
> *Subject: *Re: [QE-users] Error in ph.x<br>
> <br>
> Dear Lorenzo,<br>
> <br>
> Thanks for your suggestion. When I compile QE6.6, an error happens as <br>
> follows:<br>
> <br>
> configure error fortran could not compile .f90 files<br>
> <br>
> I have checked the gfortran in my PC:<br>
> <br>
> GNU Fortran (GCC) 4.8.3 20140911 (Red Hat 4.8.3-9)<br>
> <br>
> And its direction is /usr/bin/gfortran<br>
> <br>
> Thanks!<br>
> <br>
> Best regards,<br>
> <br>
> Clarence<br>
> <br>
> *From: *Lorenzo Paulatto <<a href="mailto:paulatz@gmail.com">mailto:paulatz@gmail.com</a>><br>
> *Sent: *2020年10月13日1:00<br>
> *To: *users@lists.quantum-espresso.org <br>
> <<a href="mailto:users@lists.quantum-espresso.org">mailto:users@lists.quantum-espresso.org</a>><br>
> *Subject: *Re: [QE-users] Error in ph.x<br>
> <br>
> use qe6.5 or 6.6<br>
> regards<br>
> <br>
> On 10/12/20 6:52 PM, LEUNG Clarence wrote:<br>
>> The Version of QE I used is QE630. Thanks.<br>
>> <br>
>> <br>
>> <br>
>> -------- Original message --------<br>
>> From: LEUNG Clarence <liangxy123@hotmail.com><br>
>> Date: 13/10/2020 00:50 (GMT+08:00)<br>
>> To: users@lists.quantum-espresso.org<br>
>> Subject: [QE-users] Error in ph.x<br>
>> <br>
>> Dear QEuser,<br>
>> <br>
>> Recently, I come across a problem in runing ph.x as follow:<br>
>> <br>
>> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
>> Error in routine phq_readin (1):<br>
>> The phonon code with LDA+U is not yet available<br>
>> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
>> <br>
>> This is a system must include DFT+U method. If I do not use DFT+U in <br>
>> scf, it cannot converge even at 1000 steps.<br>
>> <br>
>> It is very appricated that give me some advices.<br>
>> <br>
>> Best regards,<br>
>> Clarence<br>
>> Postdoc<br>
>> Department of Materials Science and Engineering<br>
>> City Univeristy of Hong Kong<br>
>> <br>
>> <br>
>> _______________________________________________<br>
>> Quantum ESPRESSO is supported by MaX (<a href="http://"></a>www.max-centre.eu <<a href="http://www.max-centre.eu">http://www.max-centre.eu</a>>)<br>
>> users mailing list users@lists.quantum-espresso.org<br>
>> <a href="https://lists.quantum-espresso.org/mailman/listinfo/users">https://lists.quantum-espresso.org/mailman/listinfo/users</a><br>
>> <br>
> <br>
> -- <br>
> Lorenzo Paulatto - Paris<br>
> _______________________________________________<br>
> Quantum ESPRESSO is supported by MaX (<a href="http://"></a>www.max-centre.eu <br>
> <<a href="http://www.max-centre.eu">http://www.max-centre.eu</a>>)<br>
> users mailing list users@lists.quantum-espresso.org<br>
> <a href="https://lists.quantum-espresso.org/mailman/listinfo/users">https://lists.quantum-espresso.org/mailman/listinfo/users</a><br>
> <br>
> <br>
> _______________________________________________<br>
> Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu">www.max-centre.eu</a>)<br>
> users mailing list users@lists.quantum-espresso.org<br>
> <a href="https://lists.quantum-espresso.org/mailman/listinfo/users">https://lists.quantum-espresso.org/mailman/listinfo/users</a><br>
> <br>
<br>
-- <br>
Lorenzo Paulatto - Paris<br>
_______________________________________________<br>
Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu">www.max-centre.eu</a>)<br>
users mailing list users@lists.quantum-espresso.org<br>
<a href="https://lists.quantum-espresso.org/mailman/listinfo/users">https://lists.quantum-espresso.org/mailman/listinfo/users</a></div>
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