Hi Meghdad,<br>You could use ld1 code for generating norm-conserving pot. for Ti.<br><a href="http://www.quantum-espresso.org/input-syntax/INPUT_LD1.html">http://www.quantum-espresso.org/input-syntax/INPUT_LD1.html</a><br>
<br>Or you can also use opium to generate it (input is already available at its website).<br><a href="http://www.sas.upenn.edu/rappegroup/htdocs/Research/psp_gga.html#Ti1">http://www.sas.upenn.edu/rappegroup/htdocs/Research/psp_gga.html#Ti1</a><br>
<br>:-)<br><br><div class="gmail_quote">On Thu, Sep 10, 2009 at 8:07 AM, meghdad saeedian <span dir="ltr"><<a href="mailto:meghdad_saeedian@yahoo.com">meghdad_saeedian@yahoo.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="border-left: 1px solid rgb(204, 204, 204); margin: 0pt 0pt 0pt 0.8ex; padding-left: 1ex;">
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Dear all,<br><br>I couldn't find the Ti norm-conserving LDA pseudopotential.<br>Would you please some one provide me with it?<br><br>Thanks in advance.<br><br>Yours,<br>Meghdad Saeedian<br><br><br>--- On <b>Thu, 9/10/09, Stefano <span>Baroni</span> <i><<a href="mailto:baroni@sissa.it" target="_blank">baroni@sissa.it</a>></i></b> wrote:<br>
<blockquote style="border-left: 2px solid rgb(16, 16, 255); margin-left: 5px; padding-left: 5px;"><br><br>From: Stefano Baroni <<a href="mailto:baroni@sissa.it" target="_blank">baroni@sissa.it</a>><br>Subject: Re: [Pw_forum] Phonon with Norm - Conserving pseudopotential<br>
To: "PWSCF Forum" <<a href="mailto:pw_forum@pwscf.org" target="_blank">pw_forum@pwscf.org</a>><br>Date: Thursday, September 10, 2009, 11:39 AM<div><div></div><div class="h5"><br><br><div>just try and let us know<div>
SB</div><div><br><div><div>On Sep 10, 2009, at 8:07 AM, meghdad saeedian wrote:</div><br><blockquote type="cite"><table border="0" cellpadding="0" cellspacing="0"><tbody><tr><td style="font-family: inherit; font-style: inherit; font-variant: inherit; font-weight: inherit; font-size: inherit; line-height: inherit; font-size-adjust: inherit; font-stretch: inherit;" valign="top">
<br>Dear all<br><br>I calculated Dispersion curve of TiO2 with ultrasoft pseudopotential. But the experimental data for checking gamma point is not enough . I want to know, How much my data will change, if I use Norm - Conserving pseudopotential?<br>
<br>Thanks in advance<br><br>Meghdad saeedian <br>M.Sc student , University of tehran <br></td></tr></tbody></table><br> _______________________________________________<br>Pw_forum mailing list<br><a rel="nofollow" href="http://mc/compose?to=Pw_forum@pwscf.org" target="_blank">Pw_forum@pwscf.org</a><br>
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<div><div style="margin: 0px;"><font size="3"><span style="font-size: 12px;">---</span></font></div><div style="margin: 0px;"><font size="3"><span style="font-size: 12px;">Stefano Baroni - SISSA</span></font><font size="3"><span style="font-size: 12px;"> </span></font><font size="3"><span style="font-size: 12px;">&</span></font><font size="3"><span style="font-size: 12px;"> </span></font><font size="3"><span style="font-size: 12px;">DEMOCRITOS National Simulation Center - Trieste</span></font></div>
<div style="margin: 0px;"><font size="3"><span style="font-size: 12px;"><a rel="nofollow" href="http://stefano.baroni.me" target="_blank">http://stefano.baroni.me</a> [+39] 040 3787 406 (tel) -528 (fax) / stefanobaroni (skype)</span></font></div>
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<span style="font-size: 14px;"><div style="margin: 0px;"><font size="3"><span style="font-size: 12px;">La morale est une logique de l'action comme la logique est une morale de la pensée - Jean Piaget</span></font></div>
<div style="margin: 0px;"><font size="3"><span style="font-size: 12px;"><br></span></font></div></span></div><div style="margin: 0px;"><font size="3"><span style="font-size: 12px;">Please, if possible, don't</span></font><font size="3"><span style="font-size: 12px;"> </span></font><font size="3"><span style="font-size: 12px;">send me MS Word or PowerPoint attachments</span></font></div>
<div style="margin: 0px;"><font size="3"><span style="font-size: 12px;">Why? See:</span></font><font size="3"><span style="font-size: 12px;"> </span></font><font color="#0023e9" size="3"><span style="font-size: 12px;"><a rel="nofollow" href="http://www.gnu.org/philosophy/no-word-attachments.html" target="_blank">http://www.gnu.org/philosophy/no-word-attachments.html</a></span></font></div>
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