<div dir="ltr">thanks for your replay<br><br>
<div class="gmail_quote">2008/10/7 Prasenjit Ghosh <span dir="ltr"><<a href="mailto:prasenjit.jnc@gmail.com">prasenjit.jnc@gmail.com</a>></span><br>
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<div dir="ltr">You can find the necessary details in the following links:<br><a href="http://www.quantum-espresso.org/wiki/index.php/Frequently_Asked_Questions#How_is_the_charge_density_.28the_potential.2C_etc..29_stored.3F_What_position_in_real_space_corresponds_to_an_array_value.3F" target="_blank">http://www.quantum-espresso.org/wiki/index.php/Frequently_Asked_Questions#How_is_the_charge_density_.28the_potential.2C_etc..29_stored.3F_What_position_in_real_space_corresponds_to_an_array_value.3F</a><br>
<a href="http://www.quantum-espresso.org/wiki/index.php/Developer_Manual#File_Formats" target="_blank">http://www.quantum-espresso.org/wiki/index.php/Developer_Manual#File_Formats</a><br><br>Prasenjit.<br><br>
<div class="gmail_quote">2008/10/7 yumin qian <span dir="ltr"><<a href="mailto:yuminqian@gmail.com" target="_blank">yuminqian@gmail.com</a>></span><br>
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<div> I need to write a small program to do some post -process calcualtion , and I need to read in the wave function and charge density , But I don't know the data structure of the wave function evc(npwx,nbnd) or evc(npwx*npol,nbnd) in noncolinear case ,In LSDA case what about the spin part of wavefunction ?and what is the mean of npol (<span style="COLOR: rgb(0,0,255); FONT-STYLE: italic">number of coordinates of wfc</span>) ?</div>
<div> thank you </div>
<p style="FONT-SIZE: 10pt; FONT-FAMILY: courier"><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" target="_blank">E-Mail:yuminqian@gmail.com</a> <br>P.O.Box 603 Beijing 100190<br>China <br><br></p></div><br></div></div>_______________________________________________<br>
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<br></blockquote></div><br><br clear="all"><br>-- <br>PRASENJIT GHOSH,<br>POST-DOC,<br>ROOM NO: 265, MAIN BUILDING,<br>CM SECTION, ICTP,<br>STRADA COSTERIA 11,<br>TRIESTE, 34104,<br>ITALY<br>PHONE: +39 040 2240 369 (O)<br>
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<br></blockquote></div><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>