[QE-users] "a" "b" values in "xanes.save" show "NaN" in xspectra calculation

[Feifei Tian]

So sorry for my mistake. The issue is
https://gitlab.com/QEF/q-e/-/issues/345.

On Thu, Jul 1, 2021 at 11:49 PM Feifei Tian <feifei.tian.cn at gmail.com>
wrote:

> Thanks for your test. I have opened an issue in gitlab (
> https://gitlab.com/QEF/q-e/-/issues/343).
>
> On Thu, Jul 1, 2021 at 6:01 PM <users-request at lists.quantum-espresso.org>
> wrote:
>
>>
>> Date: Thu, 1 Jul 2021 09:53:43 +0200
>> From: Lorenzo Paulatto <lorenzo.paulatto at sorbonne-universite.fr>
>> To: Quantum ESPRESSO users Forum <users at lists.quantum-espresso.org>
>>
>> Subject: Re: [QE-users] "a" "b" values in "xanes.save" show "NaN" in
>>         xspectra calculation
>> Message-ID: <87634EF2-43E9-4987-92FD-CCF27A2A7A66 at getmailspring.com>
>> Content-Type: text/plain; charset="utf-8"
>>
>> I could reproduce the problem, but I do not have the time to look for the
>> root cause at this point. Could you open a bug report in the tracker ?
>> https://gitlab.com/QEF/q-e/-/issues
>> Anyway, just to clarify, the xspectra code does work in many cases. It
>> could be a problem with the code or the pseudopotential.
>> cheers
>> Dr. Lorenzo Paulatto
>> IdR @ IMPMC - CNRS UMR 7590 & Sorbonne Universit?
>> phone: +33 (0)1 442 79822 / skype: paulatz
>> http://www.impmc.upmc.fr/~paulatto/
>> 23-24/423 B115, 4 place Jussieu 75252 Paris CX 05
>> On Jun 28 2021, at 4:04 am, Feifei Tian <feifei.tian.cn at gmail.com> wrote:
>>
>> End of users Digest, Vol 168, Issue 1
>> *************************************
>>
>
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