<div dir="ltr"><div><div><div>Dear pw_forum,<br><br></div>I have a question.<br><br></div>Will "asr=simple", will work for Gamma point only. i.e at 0 0 0 dynamical matrices.<br><br><br></div><div>If i use the <a href="http://asr.in">asr.in</a> file to execute case.dyn2 or case.dyn3 nothing was writing in asr.out file.<br>
<br></div><div>If i use it for case.dyn1 which was related to (0 0 0) dynamical matrix, than only asr.out file consisting with modes and there frequencies.<br><br></div><div>My system have 4 atoms which will get 12 modes.<br>
<br></div><div>If it is like this I am getting mode frequencies like this below.<br><br></div><div>mode cm-1 THz<br></div><div> 1 0.00 0.00 <br> 2 0.00 0.00 <br> 3 0.00 0.00 <br> 4 161.75 4.8492 <br>
5 161.75 4.8492 <br> 6 161.75 4.8492 <br> 7 209.56 6.2826 <br> 8 209.56 6.2826 <br> 9 209.56 6.2826 <br> 10 342.04 10.2542 <br> 11 342.04 10.2542 <br> 12 342.04 10.2542 <br>
</div><div><div><br></div><div>In this each three modes are having same frequencies.<br><br><br></div><div>How can i get mode frequencies for another dynamical matrices.<br></div><div><div><div><br><br></div></div></div>
</div>
<div></div></div>