<div dir="ltr">If I understand you email correctly, the lines<div><br></div><div>
<div style="color:rgb(0,0,0);font-size:12.8px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">"/THFS/home/renwei/venky/soft/<wbr>wien2k/lapw0_mpi: error while loading shared libraries: libmpifort.so.12: cannot open shared object file: No such file or directory<br> /THFS/home/renwei/venky/soft/<wbr>wien2k/lapw0_mpi: error while loading shared libraries: libmpifort.so.12: cannot open shared object file: No such file or directory</div><div style="color:rgb(0,0,0);font-size:12.8px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial"><br></div><div style="color:rgb(0,0,0);font-size:12.8px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">/THFS/opt/intel/composer_xe_20<wbr>13_sp1.3.174/mkl/bin/mklvars.<wbr>sh: line 118: manpath: command not found"</div><div style="color:rgb(0,0,0);font-size:12.8px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial"><br></div><div style="color:rgb(0,0,0);font-size:12.8px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">appear when the task fails. This means that, as the lines say, the shared libraries are not present on the computer you are connecting to via ssh and/or the path has not been exported.</div><br class="gmail-Apple-interchange-newline">
<br></div></div><div class="gmail_extra"><br><div class="gmail_quote">On Thu, Jun 14, 2018 at 3:37 PM, venkatesh chandragiri <span dir="ltr"><<a href="mailto:venkyphysicsiitm@gmail.com" target="_blank">venkyphysicsiitm@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div>
<div dir="ltr">
<div><br>
</div>
<div>Dear wien2k users,</div>
<div><br>
</div>
<div>I forgot to mention in my earlier mail that I have already have .ssh folder in the server where wien2k installed and already copied the key in the id_rsa.pub file to authorized_keys file . But I don't know why the second error (when I used .machines file
without lapw0 line) came </div>
<div><br>
</div>
<div>
<div><br>
</div>
<div>================ error without including lapw0 line ==========</div>
<p> LAPW0 END<br>
read identiti failed: Success<br>
ssh_exchange_identification: Connection closed by remote host^M<br>
read identiti failed: Success<br>
ssh_exchange_identification: Connection closed by remote host^M<br>
read identiti failed: Success<br>
</p>
<div>==============================<wbr>===================</div>
<div><br>
</div>
<div>[renwei@ln3 ~/.ssh]$ ls -la<br>
total 32<br>
drwx------ 2 renwei renwei 4096 Jun 15 04:10 .<br>
drwx------ 44 renwei renwei 4096 Jun 15 04:10 ..<br>
-rw------- 1 renwei renwei 1200 May 19 13:46 authorized_keys<br>
-rw------- 1 renwei renwei 1675 May 17 13:44 id_rsa<br>
-rw-r--r-- 1 renwei renwei 392 May 17 13:44 id_rsa.pub<br>
-rw-r--r-- 1 renwei renwei 11641 Jun 14 10:45 known_hosts</div>
<div><br>
</div>
<div>do I need to change the permission between the authorized_keys & id_rsa.pub ...?</div>
<div><br>
</div>
<div>thanks</div>
<div><br>
</div>
<div>venkatesh<br>
</div>
</div>
</div>
<div class="gmail_extra"><br>
<div class="gmail_quote">On Thu, Jun 14, 2018 at 11:49 PM, venkatesh chandragiri <span dir="ltr">
<<a href="mailto:venkyphysicsiitm@gmail.com" target="_blank">venkyphysicsiitm@gmail.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div dir="ltr">
<div>Dear wien2k users,</div>
<div><br>
</div>
<div>Although, I have successfully completed "init_lapw". I got errors when runned the .machines one with including the lapw0 line and the other without including it.
</div>
<div><br>
</div>
<div>I have already kept the all the linking paths in .bashrc file which are given below,</div>
<div><br>
</div>
<div>export LD_LIBRARY_PATH=$LD_LIB<wbr>RARY_PATH:/THFS/opt/intel/comp<wbr>oser_xe_2013_sp1.3.174/mkl/<wbr>lib/intel64<br>
export LD_LIBRARY_PATH=$LD_LIBRARY_PA<wbr>TH:/opt/intel/impi/<a href="https://urldefense.proofpoint.com/v2/url?u=http-3A__5.0.2.044_intel64_lib&d=DwMFaQ&c=yHlS04HhBraes5BQ9ueu5zKhE7rtNXt_d012z2PA6ws&r=U_T4PL6jwANfAy4rnxTj8IUxm818jnvqKFdqWLwmqg0&m=xWUaYuidK0A-UYTahq800UWG62rI6WBjzYxUGzTC-Wk&s=-OaHWwyxoW2EGEprMIy_k29Mczl1zNKJzlPD-rkq8xw&e=" target="_blank">5.0.2.044/<wbr>intel64/lib</a><br>
export LD_LIBRARY_PATH=$LD_LIBRARY_PA<wbr>TH:/THFS/home/renwei/venky/sof<wbr>t/libxc/lib<br>
export LD_LIBRARY_PATH=$LD_LIBRARY_PA<wbr>TH:/THFS/home/renwei/venky/sof<wbr>t/fftw/lib<br>
export LD_LIBRARY_PATH=$LD_LIBRARY_PA<wbr>TH:/usr/lib64<br>
export LD_LIBRARY_PATH=$LD_LIBRARY_PA<wbr>TH:/opt/intel/lib/intel64<br>
source /THFS/opt/intel/composer_xe_20<wbr>13_sp1.3.174/bin/compilervars.<wbr>sh intel64<br>
source /THFS/opt/intel/composer_xe_20<wbr>13_sp1.3.174/bin/ifortvars.sh intel64<br>
source /THFS/opt/intel/composer_xe_20<wbr>13_sp1.3.174/mkl/bin/mklvars.<wbr>sh intel64<br>
source /THFS/opt/intel/impi/<a href="https://urldefense.proofpoint.com/v2/url?u=http-3A__5.0.2.044_intel64_bin_mpivars.sh&d=DwMFaQ&c=yHlS04HhBraes5BQ9ueu5zKhE7rtNXt_d012z2PA6ws&r=U_T4PL6jwANfAy4rnxTj8IUxm818jnvqKFdqWLwmqg0&m=xWUaYuidK0A-UYTahq800UWG62rI6WBjzYxUGzTC-Wk&s=djvS-4ueW1GnzAkeeE5PlN4ZPj7__7_CLqPZR5ONaII&e=" target="_blank">5.0.2.044<wbr>/intel64/bin/mpivars.sh</a>
intel64</div>
<div><br>
</div>
<div>================ error with including lapw0 line ==========</div>
<div><br>
</div>
<div><br>
</div>
<div> ** LAPW1 crashed!<br>
1.909u 4.983s 0:12.42 55.3% 0+0k 0+4416io 0pf+0w<br>
error: command /THFS/home/renwei/venky/soft/w<wbr>ien2k/lapw1cpara -up -c uplapw1.def failed<br>
</div>
<div><br>
</div>
<div>=====error==========</div>
<div> begin time is Thu Jun 14 09:25:19 CST 2018</div>
<div><br>
/THFS/home/renwei/venky/soft/<wbr>wien2k/lapw0_mpi: error while loading shared libraries: libmpifort.so.12: cannot open shared object file: No such file or directory<br>
/THFS/home/renwei/venky/soft/<wbr>wien2k/lapw0_mpi: error while loading shared libraries: libmpifort.so.12: cannot open shared object file: No such file or directory</div>
<div><br>
</div>
<div>/THFS/opt/intel/composer_xe_20<wbr>13_sp1.3.174/mkl/bin/mklvars.<wbr>sh: line 118: manpath: command not found</div>
<div><br>
</div>
<div>====================</div>
<div><br>
</div>
<div><br>
</div>
<div>================ error without including lapw0 line ==========</div>
<p> LAPW0 END<br>
read identiti failed: Success<br>
ssh_exchange_identification: Connection closed by remote host^M<br>
read identiti failed: Success<br>
ssh_exchange_identification: Connection closed by remote host^M<br>
read identiti failed: Success<br>
</p>
<div>==============================<wbr>===================<br>
</div>
<div><br>
</div>
<div>Can someone help me to run the calculations and find out the reasons for the above errors.</div>
<div><br>
</div>
<div>thank you</div>
<span class="m_-5658505769251011666HOEnZb"><font color="#888888">
<div><br>
</div>
<div>venkatesh</div>
<div><br>
</div>
</font></span></div>
</blockquote>
</div>
<br>
</div>
</div>
</blockquote></div><br><br clear="all"><div><br></div>-- <br><div class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><span style="font-size:12.8px">Professor Laurence Marks</span><br></div><div dir="ltr"><span style="font-size:12.8px">"Research is to see what everybody else has seen, and to think what nobody else has thought", </span><span style="font-size:12.8px">Albert Szent-Gyorgi</span><br><a href="http://www.numis.northwestern.edu" target="_blank">www.numis.northwestern.edu</a> ; <span style="font-size:12.8px">Corrosion in 4D: </span><a href="http://MURI4D.numis.northwestern.edu" style="font-size:12.8px" target="_blank">MURI4D.numis.northwestern.edu</a><div><span style="font-size:12.8px">Partner of the CFW 100% program for gender equity, </span><a href="http://www.cfw.org/100-percent" style="font-size:12.8px" target="_blank">www.cfw.org/100-percent</a></div><div>Co-Editor, Acta Cryst A</div></div></div></div></div></div></div></div></div></div></div>
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