<div>hello L.F.Huang <br> </div>
<div>Thank you for your reply. and maybe you have read the reference you give me. </div>
<div> </div>
<div>and is that theory used in PWSCF code? <br><br></div>
<div class="gmail_quote">---------- Forwarded message ----------<br>From: <b class="gmail_sendername">lfhuang</b> <span dir="ltr"><<a href="mailto:lfhuang@theory.issp.ac.cn">lfhuang@theory.issp.ac.cn</a>></span><br>
Date: 2009/12/21<br>Subject: Re: [Pw_forum] inqure about the theory of infrared spectrum calculation<br>To: pw_forum <<a href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br><br><br>
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<div>Dear Y. H. Xu: <br>P. Umari's papers are worthy of being refered to, e.g.: <br>P. Umari, A. Pasquarello, "Infrared and Raman spectra of disordered materials from first principles" Diamond & Related Materials vol 14, p1255-1261 (2005). Or the references therein. <br>
The relevent papers citing these papers shall be not hard to trace. <br><br>Best Wishes <br>Yours Sincerely <br>L.F.Huang <br>Other papers shall be <br><font color="#444444">> Date: Sun, 20 Dec 2009 20:56:35 +0800 <br>
</font><font color="#444444">> From: xu yuehua <br></font><font color="#444444">> Subject: [Pw_forum] inqure about the theory of infrared spectrum <br></font><font color="#444444">> calculation <br></font><font color="#444444">> To: PWSCF Forum <br>
</font><font color="#444444">> Message-ID: <br></font><font color="#444444">> <br></font><font color="#444444">> Content-Type: text/plain; charset="iso-8859-1" <br></font>
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<div class="h5"><font color="#444444">> <br></font><font color="#444444">> hi everyone here: <br></font><font color="#444444">> <br></font><font color="#444444">> i am seeking some literature or paper about infrared intensity calculation <br>
</font><font color="#444444">> in PWSCF, can anyone tell me <br></font><font color="#444444">> <br></font><font color="#444444">> where is it available. <br></font><font color="#444444">> <br></font><font color="#444444">> thank you ! <br>
</font><font color="#444444">> <br></font><font color="#444444">> -- <br></font><font color="#444444">> Yuehua Xu <br></font><font color="#444444">> Group of Computational Condensed Matter Physics, <br></font><font color="#444444">> National Laboratory of Solid State Microstructures and Department of <br>
</font><font color="#444444">> Physics, <br></font><font color="#444444">> Nanjing University, <br></font><font color="#444444">> Nanjing 210093, <br></font><font color="#444444">> P. R. China <br></font></div>
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</font><font color="#444444">> <br><br>------ <br>====================================================================== <br>L.F.Huang(»ÆÁ¼·æ) ph.D candidate, DFT and phonon physics <br>====================================================================== <br>
Add: Research Laboratory for Computational Materials Sciences, <br>Instutue of Solid State Physics,the Chinese Academy of Sciences, <br>P.O.Box 1129, Hefei 230031, P.R.China <br>Tel: 86-551-5591464-328(office) <br>Fax: 86-551-5591434 <br>
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====================================================================== <br></font></a></font></a></font></a></font></div></div><br>_______________________________________________<br>Pw_forum mailing list<br><a href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>
<a href="http://www.democritos.it/mailman/listinfo/pw_forum" target="_blank">http://www.democritos.it/mailman/listinfo/pw_forum</a><br><br></div><br><br clear="all"><br>-- <br>Yuehua Xu<br>Group of Computational Condensed Matter Physics, <br>
National Laboratory of Solid State Microstructures and Department of Physics, <br>Nanjing University,<br>Nanjing 210093,<br>P. R. China<br><br>