<div dir="ltr"><div>Hi,</div><div><br></div><div>Yes. I am using the same version of pw.x and pw2wannier90.x (quantum espresso-5.4). <br></div><div><br></div><div>Thank you.<br></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sun, Nov 24, 2019 at 4:31 PM <<a href="mailto:wannier-request@lists.quantum-espresso.org">wannier-request@lists.quantum-espresso.org</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">Send Wannier mailing list submissions to<br>
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Today's Topics:<br>
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1. Error associated with the command "pw2wannier90.x" (gurshid ali)<br>
2. Re: Error associated with the command "pw2wannier90.x"<br>
(Pietro Delugas)<br>
<br>
<br>
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Message: 1<br>
Date: Sat, 23 Nov 2019 21:10:41 +0530<br>
From: gurshid ali <<a href="mailto:gurshidali@gmail.com" target="_blank">gurshidali@gmail.com</a>><br>
To: <a href="mailto:wannier@lists.quantum-espresso.org" target="_blank">wannier@lists.quantum-espresso.org</a><br>
Subject: [Wannier] Error associated with the command "pw2wannier90.x"<br>
Message-ID:<br>
<CAKuzndBpzj9jGTt1fmYgS8HAmSCpK4nj+BeGF1szJh=<a href="mailto:e4O_Ypg@mail.gmail.com" target="_blank">e4O_Ypg@mail.gmail.com</a>><br>
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Dear Wannier90 users,<br>
<br>
I am able to generate a case.nnkp file successfully after running the<br>
command wannier90.x -pp. But I am getting the following error while running<br>
*pw2wannier90.x* command which is the PWscf to Wannier90 intermediate step.<br>
<br>
<br>
<br>
* task # 0 from pw_readfile : error # 1 error<br>
opening xml data file*<br>
<br>
can someone tell me why this error is happening?<br>
<br>
Thanks in advance<br>
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Message: 2<br>
Date: Sat, 23 Nov 2019 17:02:55 +0100<br>
From: Pietro Delugas <<a href="mailto:pdelugas@sissa.it" target="_blank">pdelugas@sissa.it</a>><br>
To: <a href="mailto:wannier@lists.quantum-espresso.org" target="_blank">wannier@lists.quantum-espresso.org</a><br>
Subject: Re: [Wannier] Error associated with the command<br>
"pw2wannier90.x"<br>
Message-ID: <<a href="mailto:75f2467b-6e11-c4c3-1fe0-d688f39ca3ef@sissa.it" target="_blank">75f2467b-6e11-c4c3-1fe0-d688f39ca3ef@sissa.it</a>><br>
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<br>
Hi<br>
<br>
could you check if? you are using the same version of pw.x and <br>
pw2wannier90.x ?<br>
<br>
On 23/11/19 16:40, gurshid ali wrote:<br>
> Dear Wannier90 users,<br>
><br>
> I am able to generate a case.nnkp file successfully after running the <br>
> command wannier90.x -pp. But I am getting the following error while <br>
> running *pw2wannier90.x* command which is the PWscf to Wannier90 <br>
> intermediate step.<br>
><br>
> *task # ? ? ? ? 0<br>
> ? ? ?from pw_readfile : error # ? ? ? ? 1<br>
> ? ? ?error opening xml data file*<br>
> *<br>
> *<br>
> can someone tell me why this error is happening?*<br>
> *<br>
> *<br>
> *<br>
> Thanks in advance<br>
><br>
> _______________________________________________<br>
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