Dear All,<br><br>When I calculate the el-ph using the espresso-2.1.5, a very dense mesh is used to get goog convergence. I have changed the value of npk in parameters. I beleve it is enough big to our calculation. But when I calculate the q-point of no symmetry, the results were not saved to output file. <br>
The output follow:<br>" ........ <br> Atomic displacements:<br> There are 6 irreducible representations<br><br> Representation 1 1 modes - To be done<br><br> Representation 2 1 modes - To be done<br>
<br> Representation 3 1 modes - To be done<br><br> Representation 4 1 modes - To be done<br><br> Representation 5 1 modes - To be done<br><br> Representation 6 1 modes - To be done<br>
PHONON : 10m 9.50s CPU time"<br><br>The other content isn't shown in the file.<br><br>So I want to know if there is some limitation of output file in espresso-2.1.5.<br><br>Thanks in advance.<br><br>Sincerely<br>
<br>Yanchao<br clear="all"><br>-- <br>Yanchao Wang<br>National lab of Superhard Materials,JiLin Univ.Changchun 130012,P.R.China<br><a href="mailto:Email%3Awyanchao@gmail.com">Email:wyanchao@gmail.com</a><br>