<html><head><style id="axi-htmleditor-style" type="text/css">p { margin: 0px; }</style></head><body dir="" style="font-size: 10pt; font-family: "Source Sans Pro", sans-serif; background-image: none; background-repeat: repeat; background-attachment: fixed;">Dear Paolo,<div><br><div>I appreciate for your reply. </div><div>Yes, I recompiled the run many times. After 100 iteration, the run is terminated without any convergence. </div><div><br></div><div>Asghar</div><div><br><!--axi-signature_placeholder--><br>On Wed, 07 Tir 1402 06:17 PM, Paolo Giannozzi <paolo.giannozzi@uniud.it> wrote:<br><blockquote style="margin-left: 10px; padding-left: 10px; border-left: 1px solid #ccc;"><div style="font-family: " source="" sans="" pro",="" sans-serif;="" font-size:="" 10pt;"="">On 6/28/23 06:32, Esmaeili via users wrote:<br><br>> However, It is question for me why changing maxter does not control the <br>> maximum number of iterations!<br><br>it does. Did you recompile?<br><br>Paolo<br><br>> Asghar<br>> <br>> On Mon, 05 Tir 1402 11:43 PM, <br>> Abiodun Odusanya <a href="mailto:<aaodusanya@aggies.ncat.edu>" target="_blank"><aaodusanya@aggies.ncat.edu></a> wrote:<br>> <br>> Hi,<br>> <br>> Try reducing alpha_mix(1) to 0.1 and increase nmix_ph to 8, that<br>> should solve the problem if your structure is well relaxed.<br>> <br>> Abiodun Odusanya<br>> <br>> Graduate Assistant of Mechanical Engineering<br>> <br>> North Carolina A & T State University<br>> <br>> 1601 East Market Street<br>> <br>> Greensboro, NC 27411<br>> <br>> On Mon, Jun 26, 2023, 3:42 PM Esmaeili via users<br>> <a href="mailto:<users@lists.quantum-espresso.org" target="_blank"><users@lists.quantum-espresso.org</a><br>> <<a href="mailto:users@lists.quantum-espresso.org>" target="_blank">users@lists.quantum-espresso.org></a>> wrote:<br>> <br>> Dear developers,<br>> I'm using qe-7.1. To obtain convergence using pH.x, I increased<br>> maxster in phonon/PH/phcom.f90 from 100 to 250 but the run is<br>> also terminating at 100 iteration without convergence!<br>> I repeated maxster adjusting several times but the number of<br>> iterations doesn't increase.<br>> Would you please let me know how can I increase the number of<br>> iteration in pH.x?<br>> <br>> Yours Sincerely,<br>> Asghar<br>> _______________________________________________<br>> The Quantum ESPRESSO community stands by the Ukrainian<br>> people and expresses its concerns about the devastating<br>> effects that the Russian military offensive has on their<br>> country and on the free and peaceful scientific, cultural,<br>> and economic cooperation amongst peoples<br>> _______________________________________________<br>> Quantum ESPRESSO is supported by MaX (<a href="" data-saferedirecturl="redir.hsp?url=%68%74%74%70%3A%2F%2F%77%77%77%2E%6D%61%78%2D%63%65%6E%74%72%65%2E%65%75" 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Scienze Matematiche Informatiche e Fisiche,<br>Univ. Udine, via delle Scienze 208, 33100 Udine Italy, +39-0432-558216<br></font></div></blockquote></div></div></body></html>