[QE-users] qexml
Zahra Torbatian
z.torbatian at gmail.com
Tue Jul 24 10:50:52 CEST 2018
Dear Stefano,
Thanks so much. I hope so.
Sincerely,
Zahra
On Tue, Jul 24, 2018 at 12:18 PM, Stefano Baroni <baroni at sissa.it> wrote:
> Dear Zahra. We appreciate your willingness to experiment hidden features
> of QE. It may be a longer-term investment to do so staring with the latest
> release of QE, though … Regards — SB
>
>
> On 24 Jul 2018, at 09:43, Zahra Torbatian <z.torbatian at gmail.com> wrote:
>
> Dear pietro,
>
> thanks for your quick reply.
>
> It is used to read QE data (explained by Andrea in previous posts). I want
> to try it.
>
> Zahra
>
> On Tue, Jul 24, 2018 at 11:39 AM, Pietro Delugas <pdelugas at sissa.it>
> wrote:
>
>> Dear Zahra
>>
>> qexml.f90 is an internal module of qe. It is used inside the program
>> already.
>>
>> To compile it, you have to compile first the modules it depends on, the 2
>> only essential one I think are iotk and wrappers, the other may be skipped
>> modifying or commenting some parts of the module.
>>
>> Then you have to write a program of a subroutine that uses routines and
>> variables defined inside the module.
>>
>> If I may ask, what do you want to use the module for ?
>>
>> regards - pietro
>>
>> On 24/07/2018 08:42, Zahra Torbatian wrote:
>>
>> Dear all,
>>
>> How can I compile and use qexml. I use qe.5.2.1. I haven't found any
>> example about it.
>>
>> I really appreciate any help.
>>
>>
>>
>>
>> --------------------------
>> Zahra
>> IPM, Tehran, Iran
>>
>>
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> —
> Stefano Baroni - SISSA, Trieste - http://stefano.baroni.me, stefanobaroni
> (Skype)
>
> And aren’t we all tired of those who claim to know the answer to life,
> death and the creation being so […] sensitive about their knowledge?
> [Stephen Fry]
>
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