[QE-users] Regarding upgradation of Quantum-esspresso.

Giuseppe Mattioli giuseppe.mattioli at ism.cnr.it
Fri May 5 14:45:11 CEST 2023


Dear Chethan V
Try to use the full path to QE 7.2 when you launch pw.x (or cp.x).  
Something similar to

mpiexec -n 32 /opt/share/sw_inst/gcc-10.2.1/QE-7.2/bin/pw.x -in  
yourinput.in > youroutput.out

HTH
Giuseppe



Quoting chethanv Research Scholar <chethanv at physics.uni-mysore.ac.in>:

> Thank you for your suggestion. I have already tried installing qe7.2 but
> even after installation the  program is running with qe 6.6 only so how to
> resolve this issue.
>
>
>
> with best regards,
> Chethan V
> Research scholar
> University of Mysore
>
> On Fri, May 5, 2023 at 4:21 PM Giuseppe Mattioli <
> giuseppe.mattioli at ism.cnr.it> wrote:
>
>>
>> Dear User (please sign always your posts to this forum with name and
>> affiliation)
>> There is no such thing as an "upgrade" of Quantum ESPRESSO. You can
>> simply download and install QE 7.2.
>> HTH
>> Giuseppe
>>
>> Quoting chethanv Research Scholar <chethanv at physics.uni-mysore.ac.in>:
>>
>> > Respected sir,
>> >  I am already using Quantum espresso 6.6 in my workstation. Now i want to
>> > upgrade to the latest version i.e 7.2 but i dont no how to upgrade it.
>>
>>
>>
>> GIUSEPPE MATTIOLI
>> CNR - ISTITUTO DI STRUTTURA DELLA MATERIA
>> Via Salaria Km 29,300 - C.P. 10
>> I-00015 - Monterotondo Scalo (RM)
>> Mob (*preferred*) +39 373 7305625
>> Tel + 39 06 90672342 - Fax +39 06 90672316
>> E-mail: <giuseppe.mattioli at ism.cnr.it>
>>
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GIUSEPPE MATTIOLI
CNR - ISTITUTO DI STRUTTURA DELLA MATERIA
Via Salaria Km 29,300 - C.P. 10
I-00015 - Monterotondo Scalo (RM)
Mob (*preferred*) +39 373 7305625
Tel + 39 06 90672342 - Fax +39 06 90672316
E-mail: <giuseppe.mattioli at ism.cnr.it>



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