<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt">Dear Q.E Users.<br>I'm also a new user of Q.E. My Problem now is on the plotting Bandstructure. I have followed the tutorials (PWSCF: first steps), but the confusion normally started if i want plot my bandstructure, there are some points that did not go well when i want plot my banstructure. my system comprises GaAs on Graphene. I have read in the archives for some answers already given on similar problem especially the answer given to (correlation@tut.by) by Paolo Giannozi. But, I still need help and more explanations on this issues: <br>(1) Which Efermi ??. I usually see Efermi at the end of my nscf calculations set -2.1994 eV, is it the Efermi to consider while plotting the bandstructure? or can I set my Efermi 0.0 based on my xmgr scale which was extracted successfuly. For e.g from -10 to 10, so
that my reference point 0.0, is my Efermi? <br><div><span>(2) reference E (for tics along y)? are traced every </span><span>deltaE,?</span><span>. This statement also not clear for me. I can see that in the tutorial, the Author used </span><span class="tab"> </span><span class="tab"> </span><span>deltaE, </span><span>reference E (for tics) 1.0, 6.337 and </span>Efermi > 6.337, ???</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">However, I'm using QTiplot for my plotting, for DOS and other plots using Qti everything goes well but Bandstructure is the main issue now. <br></div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">Any advice or comments regarding
this problem, is of great importace to me.</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">Best regards.</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;"><br></div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">Shamsu Abubakar</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">Postgraduate Student</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">Physics Department<br></div><div style="color: rgb(0, 0, 0); font-size: 16px;
font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">University Putra Malaysia</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">say457@yahoo.co.uk</div><div style="color: rgb(0, 0, 0); font-size: 16px; font-family: times new roman,new york,times,serif; background-color: transparent; font-style: normal;">shamsuabubakar05@gmail.com<br></div><div><br></div> <div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"> <div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"> <div dir="ltr"> <font face="Arial" size="2"> <hr size="1"> <b><span style="font-weight:bold;">From:</span></b> "pw_forum-request@pwscf.org" <pw_forum-request@pwscf.org><br> <b><span style="font-weight: bold;">To:</span></b> pw_forum@pwscf.org <br> <b><span
style="font-weight: bold;">Sent:</span></b> Friday, 22 February 2013, 19:00<br> <b><span style="font-weight: bold;">Subject:</span></b> Pw_forum Digest, Vol 68, Issue 29<br> </font> </div> <br>Send Pw_forum mailing list submissions to<br> <a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br><br>To subscribe or unsubscribe via the World Wide Web, visit<br> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>or, via email, send a message with subject or body 'help' to<br> <a ymailto="mailto:pw_forum-request@pwscf.org" href="mailto:pw_forum-request@pwscf.org">pw_forum-request@pwscf.org</a><br><br>You can reach the person managing the list at<br> <a ymailto="mailto:pw_forum-owner@pwscf.org" href="mailto:pw_forum-owner@pwscf.org">pw_forum-owner@pwscf.org</a><br><br>When
replying, please edit your Subject line so it is more specific<br>than "Re: Contents of Pw_forum digest..."<br><br><br>Today's Topics:<br><br> 1. Reg: phonon (Swetarekha Ram)<br> 2. Re: Fwd: pwscf archive engine (Ali KACHMAR)<br> 3. Re: Fwd: pwscf archive engine (Natalia Pavlenko)<br> 4. Re: Fwd: pwscf archive engine (Axel Kohlmeyer)<br> 5. "Bad Termination" Error (Angga Fauzi)<br><br><br>----------------------------------------------------------------------<br><br>Message: 1<br>Date: Thu, 21 Feb 2013 18:26:17 +0530<br>From: Swetarekha Ram <<a ymailto="mailto:swetarekharam@gmail.com" href="mailto:swetarekharam@gmail.com">swetarekharam@gmail.com</a>><br>Subject: [Pw_forum] Reg: phonon<br>To: <a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br>Message-ID:<br> <CAFsnUVbcz9EGV=<a
ymailto="mailto:SjY8Dr_4Uym0juSOED5M5ZqvqgX7zDrLW9Rg@mail.gmail.com" href="mailto:SjY8Dr_4Uym0juSOED5M5ZqvqgX7zDrLW9Rg@mail.gmail.com">SjY8Dr_4Uym0juSOED5M5ZqvqgX7zDrLW9Rg@mail.gmail.com</a>><br>Content-Type: text/plain; charset=ISO-8859-1<br><br>Dear Users,<br><br>I am using the pwscf package to calculate the Tc and phonon dispersion.<br><br>To analyse more details, I need some help.<br><br> Can any one give idea how to get phonon linewidth ?<br><br>I have done the superconducting transition temperature calculation and<br>from that I have got Tc and Wln (K) values.<br><br>Now to get the <w> and (<w>^2)^(1/2) values, what should I do.<br><br>In addition, I want to plot the alpha^2 Vs frequency, from where I can<br>get only alpha^2 data, not the alpha^2F(w)<br><br><br>-- <br>Swetarekha Ram,<br><br><br>------------------------------<br><br>Message: 2<br>Date: Thu, 21 Feb 2013 12:58:40 +0000<br>From: Ali KACHMAR <<a
ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br>To: <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>Message-ID: <<a ymailto="mailto:BAY173-W470C4CE56B74837B81BF66FEF70@phx.gbl" href="mailto:BAY173-W470C4CE56B74837B81BF66FEF70@phx.gbl">BAY173-W470C4CE56B74837B81BF66FEF70@phx.gbl</a>><br>Content-Type: text/plain; charset="iso-8859-1"<br><br><br>You could look for instance into this pwscf archive.<br><br><a href="http://www.democritos.it/pipermail/pw_forum/" target="_blank">http://www.democritos.it/pipermail/pw_forum/</a><br><br>Best regards,<br>Ali Kachmar<br>Date: Thu, 21 Feb 2013 01:51:02 -0800<br>From: <a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a><br>To: <a ymailto="mailto:pw_forum@pwscf.org"
href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br><br>The server restarted, but the problem with access remains.<br> Dr. Natalia Pavlenko<br>Institute of Physics, University of Augsburg<br>Germany<br>Tel.: +49-821-5983666<br>Fax: +49-821-5983752<br><a href="https://sites.google.com/site/natalia2pavlenko" target="_blank">https://sites.google.com/site/natalia2pavlenko</a><br><br> From: Ali Kachmar <<a ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br> To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>> <br> Sent: Thursday, February 21, 2013 10:13 AM<br> Subject: [Pw_forum] Fwd: pwscf archive engine<br> <br><br><br>Begin forwarded message:<br><br>From: Paolo Giannozzi <<a ymailto="mailto:giannozz@democritos.it"
href="mailto:giannozz@democritos.it">giannozz@democritos.it</a>><br>Date: 20 February, 2013 6:12:02 PM GMT+01:00<br>To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>Subject: Re: [Pw_forum] pwscf archive engine<br>Reply-To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br><br>On Wed, 2013-02-20 at 09:22 +0000, Ali KACHMAR<br> wrote:<br><br>I think an excellent engine for searching of QE archive is broken<br><br>the server was down. It has just restarted (I hope)<br><br>P.<br>-- <br>Paolo Giannozzi, IOM-Democritos and University of Udine, Italy<br><br><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum"
target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br><br><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br><br> <br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a> <br>-------------- next part --------------<br>An HTML attachment was scrubbed...<br>URL: <a
href="http://pwscf.org/pipermail/pw_forum/attachments/20130221/4cf8ffe4/attachment-0001.html" target="_blank">http://pwscf.org/pipermail/pw_forum/attachments/20130221/4cf8ffe4/attachment-0001.html</a> <br><br>------------------------------<br><br>Message: 3<br>Date: Thu, 21 Feb 2013 05:22:19 -0800 (PST)<br>From: Natalia Pavlenko <<a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a>><br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br>To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>Message-ID:<br> <<a ymailto="mailto:1361452939.67663.YahooMailNeo@web5814.biz.mail.ne1.yahoo.com" href="mailto:1361452939.67663.YahooMailNeo@web5814.biz.mail.ne1.yahoo.com">1361452939.67663.YahooMailNeo@web5814.biz.mail.ne1.yahoo.com</a>><br>Content-Type: text/plain; charset="iso-8859-1"<br><br><br>Unfortunately,
the "search" option is not implemented there.<br><br>Best, Natalia Pavlenko<br><br>From: Ali KACHMAR <<a ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br><br>To: <a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a> <br>Sent: Thursday, February 21, 2013 1:58 PM<br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br> <br><br> <br>You could look for instance into this pwscf archive.<br><br><a href="http://www.democritos.it/pipermail/pw_forum/" target="_blank">http://www.democritos.it/pipermail/pw_forum/</a><br><br>Best regards,<br>Ali Kachmar<br><br><br>________________________________<br>Date: Thu, 21 Feb 2013 01:51:02 -0800<br>From: <a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a><br>To: <a ymailto="mailto:pw_forum@pwscf.org"
href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br><br><br>The server restarted, but the problem with access remains.<br><br>?<br>Dr. Natalia Pavlenko<br>Institute of Physics, University of Augsburg<br>Germany<br>Tel.: +49-821-5983666<br>Fax: +49-821-5983752<br><a href="https://sites.google.com/site/natalia2pavlenko" target="_blank">https://sites.google.com/site/natalia2pavlenko</a><br><br><br><br>________________________________<br> From: Ali Kachmar <<a ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br>To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>> <br>Sent: Thursday, February 21, 2013 10:13 AM<br>Subject: [Pw_forum] Fwd: pwscf archive engine<br> <br><br><br>Begin forwarded message:<br><br><br>From: Paolo Giannozzi <<a
ymailto="mailto:giannozz@democritos.it" href="mailto:giannozz@democritos.it">giannozz@democritos.it</a>><br>>Date: 20 February, 2013 6:12:02 PM GMT+01:00<br>>To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>>Subject: Re: [Pw_forum] pwscf archive engine<br>>Reply-To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>><br>><br>On Wed, 2013-02-20 at 09:22 +0000, Ali KACHMAR wrote:<br>><br>><br>>I think an excellent engine for searching of QE archive is broken<br>>><br>>the server was down. It has just restarted (I hope)<br>><br>>P.<br>>-- <br>>Paolo Giannozzi, IOM-Democritos and University of Udine, Italy<br>><br>><br>>_______________________________________________<br>>Pw_forum mailing list<br>><a ymailto="mailto:Pw_forum@pwscf.org"
href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>><br>><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br><br><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org"
href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>-------------- next part --------------<br>An HTML attachment was scrubbed...<br>URL: <a href="http://pwscf.org/pipermail/pw_forum/attachments/20130221/b707ba77/attachment-0001.html" target="_blank">http://pwscf.org/pipermail/pw_forum/attachments/20130221/b707ba77/attachment-0001.html</a> <br><br>------------------------------<br><br>Message: 4<br>Date: Thu, 21 Feb 2013 14:31:53 +0100<br>From: Axel Kohlmeyer <<a ymailto="mailto:akohlmey@gmail.com" href="mailto:akohlmey@gmail.com">akohlmey@gmail.com</a>><br>Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br>To: Natalia Pavlenko <<a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a>>, PWSCF Forum<br> <<a ymailto="mailto:pw_forum@pwscf.org"
href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>Message-ID:<br> <CADTmJ6F=<a ymailto="mailto:qpHseR2CBYKrHV0ePoz0DhKzohSxbQTGcwipmOCVMg@mail.gmail.com" href="mailto:qpHseR2CBYKrHV0ePoz0DhKzohSxbQTGcwipmOCVMg@mail.gmail.com">qpHseR2CBYKrHV0ePoz0DhKzohSxbQTGcwipmOCVMg@mail.gmail.com</a>><br>Content-Type: text/plain; charset=ISO-8859-1<br><br>On Thu, Feb 21, 2013 at 2:22 PM, Natalia Pavlenko <<a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a>> wrote:<br>><br>> Unfortunately, the "search" option is not implemented there.<br><br>if everything else breaks, you can always search using google and<br>restricting the search to a domain using the "site:" qualifier:<br><br>my search words site:democritos.it<br><br>i often found this to yield more relevant results. only the search<br>index isn't updated as quickly as a local
search.<br><br>axel.<br><br><br>><br>> Best, Natalia Pavlenko<br>><br>> From: Ali KACHMAR <<a ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br>> To: <a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br>> Sent: Thursday, February 21, 2013 1:58 PM<br>><br>> Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br>><br>> You could look for instance into this pwscf archive.<br>><br>> <a href="http://www.democritos.it/pipermail/pw_forum/" target="_blank">http://www.democritos.it/pipermail/pw_forum/</a><br>><br>> Best regards,<br>> Ali Kachmar<br>> ________________________________<br>> Date: Thu, 21 Feb 2013 01:51:02 -0800<br>> From: <a ymailto="mailto:natalia@npavlenko.com" href="mailto:natalia@npavlenko.com">natalia@npavlenko.com</a><br>> To: <a ymailto="mailto:pw_forum@pwscf.org"
href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a><br>> Subject: Re: [Pw_forum] Fwd: pwscf archive engine<br>><br>> The server restarted, but the problem with access remains.<br>><br>> Dr. Natalia Pavlenko<br>> Institute of Physics, University of Augsburg<br>> Germany<br>> Tel.: +49-821-5983666<br>> Fax: +49-821-5983752<br>> <a href="https://sites.google.com/site/natalia2pavlenko" target="_blank">https://sites.google.com/site/natalia2pavlenko</a><br>><br>> ________________________________<br>> From: Ali Kachmar <<a ymailto="mailto:kachmar_ali@hotmail.fr" href="mailto:kachmar_ali@hotmail.fr">kachmar_ali@hotmail.fr</a>><br>> To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>> Sent: Thursday, February 21, 2013 10:13 AM<br>> Subject: [Pw_forum] Fwd: pwscf archive engine<br>><br>><br>> Begin forwarded
message:<br>><br>> From: Paolo Giannozzi <<a ymailto="mailto:giannozz@democritos.it" href="mailto:giannozz@democritos.it">giannozz@democritos.it</a>><br>> Date: 20 February, 2013 6:12:02 PM GMT+01:00<br>> To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>> Subject: Re: [Pw_forum] pwscf archive engine<br>> Reply-To: PWSCF Forum <<a ymailto="mailto:pw_forum@pwscf.org" href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>><br>> On Wed, 2013-02-20 at 09:22 +0000, Ali KACHMAR wrote:<br>><br>> I think an excellent engine for searching of QE archive is broken<br>><br>><br>> the server was down. It has just restarted (I hope)<br>><br>> P.<br>> --<br>> Paolo Giannozzi, IOM-Democritos and University of Udine, Italy<br>><br>><br>> _______________________________________________<br>> Pw_forum mailing list<br>>
<a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>><br>><br>> _______________________________________________<br>> Pw_forum mailing list<br>> <a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>><br>><br>> _______________________________________________ Pw_forum mailing list<br>> <a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>><br>> _______________________________________________<br>> Pw_forum mailing list<br>> <a
ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br>><br>><br>> _______________________________________________<br>> Pw_forum mailing list<br>> <a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br><br><br><br>-- <br>Dr. Axel Kohlmeyer <a ymailto="mailto:akohlmey@gmail.com" href="mailto:akohlmey@gmail.com">akohlmey@gmail.com</a> <a href="http://goo.gl/1wk0" target="_blank">http://goo.gl/1wk0</a><br>International Centre for Theoretical Physics, Trieste. Italy.<br><br><br>------------------------------<br><br>Message: 5<br>Date: Thu, 21 Feb 2013 20:09:22 -0800 (PST)<br>From: Angga Fauzi <<a
ymailto="mailto:angga_dito_fauzi@yahoo.com" href="mailto:angga_dito_fauzi@yahoo.com">angga_dito_fauzi@yahoo.com</a>><br>Subject: [Pw_forum] "Bad Termination" Error<br>To: "<a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a>" <<a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a>><br>Message-ID:<br> <<a ymailto="mailto:1361506162.85524.YahooMailNeo@web161301.mail.bf1.yahoo.com" href="mailto:1361506162.85524.YahooMailNeo@web161301.mail.bf1.yahoo.com">1361506162.85524.YahooMailNeo@web161301.mail.bf1.yahoo.com</a>><br>Content-Type: text/plain; charset="iso-8859-1"<br><br>Dear PWscf users,<br><br>I was trying to run nscf calculation for my system. Suddenly, the process was interrupted. I started the process again using restart_mode='restart', but it didn't work and "Bad Termination" error was appear. Could anyone tell me how to overcome this
problem?<br><br>Best regards,<br>Angga<br>?<br>Angga Dito Fauzi<br>Undergraduate Student<br>Department of Physics, Faculty of Mathematics and Natural Sciences<br>Universitas Indonesia, Depok 16424, Indonesia<br>Phone: +628124139348<br>Email: <a ymailto="mailto:angga_dito_fauzi@yahoo.com" href="mailto:angga_dito_fauzi@yahoo.com">angga_dito_fauzi@yahoo.com</a><br>-------------- next part --------------<br>An HTML attachment was scrubbed...<br>URL: <a href="http://pwscf.org/pipermail/pw_forum/attachments/20130221/d0ed7027/attachment-0001.html" target="_blank">http://pwscf.org/pipermail/pw_forum/attachments/20130221/d0ed7027/attachment-0001.html</a> <br><br>------------------------------<br><br>_______________________________________________<br>Pw_forum mailing list<br><a ymailto="mailto:Pw_forum@pwscf.org" href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br><a href="http://pwscf.org/mailman/listinfo/pw_forum"
target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br><br>End of Pw_forum Digest, Vol 68, Issue 29<br>****************************************<br><br><br> </div> </div> </div></body></html>