<div dir="auto">Thank you for your response. I want to ask you that if I complete the process by clicking continue initlapw without saving will it affect my results as doing so I didn't find any error in scf convergence.<div dir="auto"><br></div><div dir="auto">One more thing this " System Error....Couldn't write to/." didn't observe in other molecules like BP, ZnSiP2 and other.</div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, 21 Jul, 2023, 8:14 AM Gavin Abo, <<a href="mailto:gabo13279@gmail.com">gabo13279@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div>
<p>On an older, slower computer system, I was able to reproduce the
error displayed in w2web as:</p>
<p><b>System Error</b></p>
<p>Couldn't write to /.</p>
<p><u>back to last page</u><br>
</p>
<p>To produce the error, what I did in w2web was 1) I clicked the
"view case.outputd and cp case.in0_std case.in0" button, 2) paused
about 5 seconds, and 3) clicked the "Save and initlapw" button.</p>
<p>The file size of the case.outputd is 43.6 MB. I suspect the
error results because my computer is slow in opening the
case.outputd file where I clicked on the save button before the
file got opened up.</p>
<p>When I clicked "view case.klist" followed by clicking as fast as
possible "Save and initlapw", I do not encounter the same error.
The file size of case.klist, however, is only 101 bytes.</p>
<p>I also 1) clicked the "view case.outputd and cp case.in0_std
case.in0" button, 2) paused about 1 minute, and 3) clicked the
"Save and initlapw" button. When doing that, the error did not
occur.<br>
</p>
<p>I put the 43.6 MB case.outputd on a new faster computer system
clicking the "Save and initlapw" button immediately after having
clicked the "view case.outputd and cp case.in0_std case.in0"
button and the error do not appear.</p>
<p>From that, it seems to be a computer system resource limitation
that is causing the error.</p>
<p>Kind Regards,</p>
Gavin<br>
WIEN2k user<br>
<div><br>
</div>
<div>On 7/14/2023 4:59 AM, karina Khan
wrote:<br>
</div>
<blockquote type="cite">
<div dir="ltr">
<div dir="auto">Ok I will keep this thing in my mind for future</div>
<div dir="auto">This command works well with different systems
like Cs2AgInBr6, BP but not with system having molecular
formula C24H72N8In2Br14 and C16H20O7<br>
</div>
</div>
<br>
<div class="gmail_quote">
<div dir="ltr" class="gmail_attr">On Thu, 13 Jul, 2023, 8:34 PM
Peter Blaha, <<a href="mailto:peter.blaha@tuwien.ac.at" target="_blank" rel="noreferrer">peter.blaha@tuwien.ac.at</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">
<div>
<p>I cannot reproduce this. It works perfectly fine with me.</p>
<p>Please try again in another case. Or use the recommended
fast mode. This will set automatically good parameters in
case.in0/1/2 and klist, and not the "stupid" defaults of
the step by step initialization.</p>
<p>PS: You cannot send large images to the mailing list.
There is a limit of 40 kB per message.<br>
</p>
<p><br>
</p>
<div>Am 13.07.2023 um 11:48 schrieb karina Khan:<br>
</div>
<blockquote type="cite">
<div dir="ltr">
<div>Dear Wien2k users,</div>
<div> During initialisation, I
stuck up in the step <b>view case.outpd and cp
case.in0_std case.in0, </b>when I click on the step
save and initlapw, I get a <b>System Error couldn't
write to/. </b> back to last page. <br>
</div>
<div>However this step is working for the other sample
but not for this new sample having 32 atoms.</div>
<div>Looking for your suggestions</div>
<div>
<div dir="ltr" class="gmail_signature">
<div dir="ltr">
<div>
<div dir="ltr">
<div>
<div dir="ltr">
<div>
<div dir="ltr"><b><font color="#0b5394">Thanks
& Regards<span style="font-family:Wingdings;font-size:48px"></span></font></b></div>
<div><b><font color="#0b5394">Karina
Khan</font></b></div>
<div style="margin:0px;padding:0px 0px 20px;width:1142px;font-family:Roboto,RobotoDraft,Helvetica,Arial,sans-serif;font-size:medium">
<div>
<div style="font-size:12.8px;margin:8px 0px 0px;padding:0px">
<div>
<div dir="ltr">
<div>
<div dir="ltr"><span>
<div><br>
<span></span><span></span></div>
</span></div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
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<br>
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<pre cols="72">--
-----------------------------------------------------------------------
Peter Blaha, Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-158801165300
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