<html><head></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space; "><br><div><div>Il giorno 26/mag/2011, alle ore 12.24, priyanka goud ha scritto:</div><br class="Apple-interchange-newline"><blockquote type="cite">Dear PWSCF users,<br><br> I have came across an error while using hybrid XC functional as Input_dft = "PBE0" using ultrasoft psedopotentials of PBE for C,H,N,S atoms.<br>Job terminated with an error "HYBRID XC not implemented for USPP or PAW".<br>
<br>For the same I could able to run my job with hybrid XC functional Input_dft = "B3LYP" using norm conservative pseudopotentials.<br></blockquote><div><br></div>norm conserving</div><div><br><blockquote type="cite"><br>Can any one please say me can't we implement hybrid XC functional for ultrsoft pseudo potentials.<br></blockquote><div><br></div><div>Yes, you can implement it. Indeed you would be the most welcome if you do it!</div><div><br></div><div><br></div><div>Regards,</div><div><br></div><div>GS</div><br><blockquote type="cite">
<br><br> <br clear="all"><br>-- <br><font face="comic sans ms,sans-serif"><font face="georgia,serif"><i><font color="#000000">With Regards</font></i>,<br><br></font>B.Priyanka,<br>Research Scholar,<br>
Computational Chemistry,<br>IICT,Habsiguda,<br>India.</font><br>
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<span class="Apple-style-span" style="border-collapse: separate; color: rgb(0, 0, 0); font-family: Helvetica; font-size: medium; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: normal; orphans: 2; text-align: auto; text-indent: 0px; text-transform: none; white-space: normal; widows: 2; word-spacing: 0px; -webkit-border-horizontal-spacing: 0px; -webkit-border-vertical-spacing: 0px; -webkit-text-decorations-in-effect: none; -webkit-text-size-adjust: auto; -webkit-text-stroke-width: 0px; "><div><span class="Apple-style-span" style="color: rgb(126, 126, 126); font-size: 16px; font-style: italic; "><br class="Apple-interchange-newline">§ Gabriele Sclauzero, EPFL SB ITP CSEA</span></div><div><font class="Apple-style-span" color="#7E7E7E"><i> PH H2 462, Station 3, CH-1015 Lausanne</i></font></div></span>
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