I think you need to use dynmat.x and obtain something like the following in the standard output<br><br><pre># mode [cm-1] [THz] IR Raman depol
1 0.00 -0.0001 0.0000 0.0000 0.7298
2 0.00 0.0000 0.0000 0.0000 0.4596</pre><br>Then, look at <br>
<a href="http://www.democritos.it/pipermail/pw_forum/2012-January/023112.html">http://www.democritos.it/pipermail/pw_forum/2012-January/023112.html</a><br><br>If there is some code to automatically produce a nice plot, let me know, please. <br>
<br>---------- Mensaje reenviado ----------<br>From: Prasenjit Ghosh <<a href="mailto:prasenjit.jnc@gmail.com">prasenjit.jnc@gmail.com</a>><br>To: PWSCF Forum <<a href="mailto:pw_forum@pwscf.org">pw_forum@pwscf.org</a>><br>
Cc: <br>Date: Sat, 13 Oct 2012 17:18:08 +0530<br>Subject: [Pw_forum] Raman spectra<br>Dear all,<br><br>I have obtained the raman cross-section using ph.x<br><br>I
want to plot the Intensity vs frequency plot of the raman spectrum. Is
there some executable or flag in the input files which calculates the
data or I need to write a small piece of code to do so?<br>
<br>With regards,<br><br>Prasenjit<br><br clear="all"><br>-- <br><div><br></div>
<div><br></div>Eduardo Menendez Proupin<div>Departamento de Química Fisica Aplicada<br>Facultad de Ciencias<br>Universidad Autónoma de Madrid<br>28049 Madrid, Spain<br></div><div>Phone: +34 91 497 6706</div><div><br></div>
<br>