<div dir="ltr"><div dir="ltr">Dear Sir,<br><br>              I am trying to do  a testrun for the example febcc but getting the following errors. The compilation was okay. After the compilation I have done ./userconfig_lapw. But it is adding the paths for WIEN2k in bashrc file. Sir there is no userconfig_lapw in WEINncm directory. Then how will I add the executables of the WIENncm in the bashrc file?<div>..................................................................................................................................<br></div><div>Errror</div><div>(base) [19ph92r03@login06 febcc]$ runncm<br>runncm with  /scratch/19ph92r03/safikul/WIENNCM/WIENNCM<br>in cycle 1    ETEST: 0   CTEST: 0<br>/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw0: Command not found.<br>/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw1c: Command not found.<br>/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw2c: Command not found.<br>CORE - Error<br>...................................................................................................................................</div><div><br></div><div>             Sir I eanestly request  you to please help me to sort out this issue.</div><div><br></div><div>Kind Regards,</div><div>Safikul Islam</div><div><br></div><div>             <br><br></div></div><br><img width="0" height="0" class="mailtrack-img" alt="" style="display:flex" src="https://mailtrack.io/trace/mail/4443ccb0c7117e601c151e4d56ff7db5a08da567.png?u=7959735"><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sat, Nov 18, 2023 at 12:50 AM Safikul Islam <<a href="mailto:safikul.physics1996@gmail.com">safikul.physics1996@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div dir="ltr">Dear  Professor Peter Blaha,<div><br></div><div>The compilation is successful. I will try to recalculate for the given examples. I want to thank you so much for your kindness and your great assistance.</div><div><br></div><div>Kind Regards,</div><div>Safikul Islam<br><br><br><br></div></div><br><img width="0" height="0" alt="" style="display: flex;" src="data:image/gif;base64,R0lGODlhAQABAIAAAAAAAP///yH5BAEAAAAALAAAAAABAAEAAAIBRAA7"><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Nov 17, 2023 at 10:31 PM Safikul Islam <<a href="mailto:safikul.physics1996@gmail.com" target="_blank">safikul.physics1996@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div dir="ltr">Dear  Professor Peter Blaha,<div><br></div><div>               I followed your suggestion. I have adopted all the libraries and Makefiles from the WIEN2k installation directory.  Now the errors have been reduced. Only one error is coming.</div><div>..............................................................................................................................</div><div>Error:</div><div>Compile time errors (if any) were:<br>SRC_dstart/compile.msg:ifort: error #10236: File not found:  'cputim.o'<br>SRC_dstart/compile.msg:make: *** [dstart] Error 1</div><div>..............................................................................................................................</div><div><br></div><div>              </div><div>              Sir please help me to resolve this issue.<br></div><div><br></div><div>Kind Regards,</div><div>Safikul Islam</div><div><br><br><br></div></div><br><img width="0" height="0" alt="" style="display: flex;" src="data:image/gif;base64,R0lGODlhAQABAIAAAAAAAP///yH5BAEAAAAALAAAAAABAAEAAAIBRAA7"><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Nov 17, 2023 at 8:19 PM Safikul Islam <<a href="mailto:safikul.physics1996@gmail.com" target="_blank">safikul.physics1996@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div dir="ltr">Dear Professor Peter Blaha,<div><br></div><div>You are right. The path of ifortran compiler was not adjusted properly in the bashrc  file. After giving the proper path of ifortran compiler I am getting the following errors during compilation of the WIENncm software. I have pasted the error of the compile.msg file of the SRC_displacement folder.</div><div>.................................................................................................................................................................</div><div><b><font color="#0000ff">Compile time errors (if any) were:</font><br>SRC_displacement/compile.msg:make: *** [displacement] Error 1<br>SRC_dstart/compile.msg:ifort: error #10236: File not found:  'cputim.o'<br>SRC_dstart/compile.msg:make: *** [dstart] Error 1<br>SRC_lapw0/compile.msg:make[1]: *** [lapw0] Error 1<br>SRC_lapw0/compile.msg:make: *** [seq] Error 2<br>SRC_lapw1/compile.msg:make[1]: *** [lapw1c] Error 1<br>SRC_lapw1/compile.msg:make: *** [complex] Error 2<br>SRC_lapw2/compile.msg:make[1]: *** [lapw2c] Error 1<br>SRC_lapw2/compile.msg:make: *** [complex] Error 2<br>SRC_lapwdm/compile.msg:make[1]: *** [lapwdmc] Error 1<br>SRC_lapwdm/compile.msg:make: *** [complex] Error 2<br>SRC_mixer/compile.msg:make: *** [mixer] Error 1<br>SRC_mixer_old/compile.msg:make: *** [mixer] Error 1<br>SRC_ncmsymmetry/compile.msg:make: *** [ncmsymmetry] Error 1</b><br>....................................................................................................................................................................<br><br><b><font color="#ff0000">SRC_displacement/compile.msg error</font></b><br><b>ifort -o ./displacement module.o gtfnam.o errflg.o errclr.o outerr.o displacement.o determinant.o euler.o inversa.o make_point_groups.o find_displacement.o lapack.o lapack2.o -L../SRC_lib -L/opt/intel/mkl60/lib/32 -Vaxlib -static -lmkl_lapack -lmkl_p4 -lguide -lpthread<br>ifort: command line remark #10010: option '-Vaxlib' is deprecated and will be removed in a future release. See '-help deprecated'<br>ld: cannot find -lmkl_lapack<br>ld: cannot find -lmkl_p4<br>ld: cannot find -lguide<br>/usr/lib/../lib64/libpthread.a(libpthread.o): In function `sem_open':<br>(.text+0x77cd): warning: the use of `mktemp' is dangerous, better use `mkstemp'<br>make: *** [displacement] Error 1</b></div><div><b>..........................................................................................................................................................................</b></div><div><b><br></b></div><div><b><br></b></div><div>Sir, how should I proceed now? I kindly request you to please help me to sort out this problem.<br><div></div><br></div><div>Kind Regards,</div><div>Safikul Islam</div><div><br></div><div><br></div><div><br></div><div><br><br><br><br></div><br></div><br><img width="0" height="0" alt="" style="display: flex;" src="data:image/gif;base64,R0lGODlhAQABAIAAAAAAAP///yH5BAEAAAAALAAAAAABAAEAAAIBRAA7"><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Nov 17, 2023 at 1:28 PM Safikul Islam <<a href="mailto:safikul.physics1996@gmail.com" target="_blank">safikul.physics1996@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr">Dear Wien2k  users and developers,<div><br></div><div>  I am trying to install WIENncm  using ifortran compiler version 18.0.0. But I am getting many errors. The error has been attached with this mail. I have looked into the previous messages regarding the installation of WIENncm. It has been suggested that WIENncm is compatible with ifortran compiler version 11.xxx. But right now I am unable to change ifortran compiler version from 18.0.0 to ifortran 11.xxx. Could anyone suggest to me how I will install WIENncm using ifortran 18.0.0? If anyone has installed it by changing the makefiles I am requesting you to please help me regarding this issue. I will remain thankful to you.</div><div><div><br></div><div> Kind Regards,              <div dir="ltr" class="gmail_signature"><div dir="ltr"><div style="color:rgb(136,136,136)"><font color="#cc0000"><b>SAFIKUL ISLAM</b></font><br style="color:rgb(34,34,34)"><div style="color:rgb(34,34,34)"><div><div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">[Ph.D Research Scholar]</font></span></div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------</font></span></div><font color="#0000ff"><span style="font-family:georgia,serif"></span></font></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Department of Physics.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Indian Institute of Technology, <br>Kharagpur.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">West Bengal, India.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff"><u>Pin Code</u>:- 721302.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------<br><u>Contact</u>:- 9832979985</font></span></div></div></div></div></div><br></div></div><img width="0" height="0" alt="" style="display: flex;" src="data:image/gif;base64,R0lGODlhAQABAIAAAAAAAP///yH5BAEAAAAALAAAAAABAAEAAAIBRAA7"></div>
</blockquote></div><br clear="all"><div><br></div><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div style="color:rgb(136,136,136)"><font color="#cc0000"><b>SAFIKUL ISLAM</b></font><br style="color:rgb(34,34,34)"><div style="color:rgb(34,34,34)"><div><div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">[Ph.D Research Scholar]</font></span></div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------</font></span></div><font color="#0000ff"><span style="font-family:georgia,serif"></span></font></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Department of Physics.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Indian Institute of Technology, <br>Kharagpur.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">West Bengal, India.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff"><u>Pin Code</u>:- 721302.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------<br><u>Contact</u>:- 9832979985</font></span></div></div></div></div></div></div>
</blockquote></div><br clear="all"><div><br></div><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div style="color:rgb(136,136,136)"><font color="#cc0000"><b>SAFIKUL ISLAM</b></font><br style="color:rgb(34,34,34)"><div style="color:rgb(34,34,34)"><div><div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">[Ph.D Research Scholar]</font></span></div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------</font></span></div><font color="#0000ff"><span style="font-family:georgia,serif"></span></font></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Department of Physics.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Indian Institute of Technology, <br>Kharagpur.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">West Bengal, India.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff"><u>Pin Code</u>:- 721302.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------<br><u>Contact</u>:- 9832979985</font></span></div></div></div></div></div></div>
</blockquote></div><br clear="all"><div><br></div><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div style="color:rgb(136,136,136)"><font color="#cc0000"><b>SAFIKUL ISLAM</b></font><br style="color:rgb(34,34,34)"><div style="color:rgb(34,34,34)"><div><div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">[Ph.D Research Scholar]</font></span></div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------</font></span></div><font color="#0000ff"><span style="font-family:georgia,serif"></span></font></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Department of Physics.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Indian Institute of Technology, <br>Kharagpur.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">West Bengal, India.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff"><u>Pin Code</u>:- 721302.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------<br><u>Contact</u>:- 9832979985</font></span></div></div></div></div></div></div>
</blockquote></div><br clear="all"><div><br></div><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div style="color:rgb(136,136,136)"><font color="#cc0000"><b>SAFIKUL ISLAM</b></font><br style="color:rgb(34,34,34)"><div style="color:rgb(34,34,34)"><div><div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">[Ph.D Research Scholar]</font></span></div><div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------</font></span></div><font color="#0000ff"><span style="font-family:georgia,serif"></span></font></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Department of Physics.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">Indian Institute of Technology, <br>Kharagpur.<br></font></span></div></div><div><span style="font-family:georgia,serif"><font color="#0000ff">West Bengal, India.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff"><u>Pin Code</u>:- 721302.<br></font></span></div><div><span style="font-family:georgia,serif"><font color="#0000ff">---------------------------------------------------<br><u>Contact</u>:- 9832979985</font></span></div></div></div></div></div></div>