<div dir="ltr"><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: #0000ff; 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">E-Mail:yuminqian@gmail.com</a> <br>P.O.Box 603 Beijing 100190<br>China <br><br></p></div>