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<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0px 0px 0px 0.8ex; BORDER-LEFT: #ccc 1px solid">I meet with a problem , I use the newest version of PWSCF code. the output file of charge density is suffix.dat , it's a binary file . and the wave function file is suffix.wfcx is also a binary file. but the </blockquote>
</div> file contains the system info is data-file.xml , my question is how to set input parameter to make the out put files of wavefuntion and charge density in xml format. <br><br clear="all"><br>-- <br>Sincerely Y. M. Qian <br>
Lab.of Condensed Matter Theory and Materials Computation <br>Institute of Physics <br>Chinese Academy of Sciences<br>Tel: + 8610 8264 9147<br><a href="mailto:E-Mail%3Ayuminqian@gmail.com">E-Mail:yuminqian@gmail.com</a> <br>
P.O.Box 603 Beijing 100190<br>China <br><br></div>