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    <p class="MsoNormal"
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style="mso-ascii-font-family:Calibri;mso-hansi-font-family:Calibri;mso-bidi-font-family:Calibri;mso-ansi-language:EN"
        lang="EN">At risk of stating the obvious: the fact that the
        folder is called win2k and not wien2k also seems mildly
        suspicious.</span><br>
    </p>
    <div class="moz-cite-prefix">On 2/16/2016 2:28 PM, Gavin Abo wrote:<br>
    </div>
    <blockquote cite="mid:56C323EF.40400@crimson.ua.edu" type="cite">
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      <div class="moz-cite-prefix">If you do "ls
        ~/home/IITJHOME/ambeshst/win2k13mpi/phonopy-1.10.0/lib64/python",
        does it show files like api_gruneisen.py?<br>
        <br>
        If the files like that are in the python folder in the lib64
        directory, then your .bashrc looks fine.  On my system, they are
        under lib instead of lib64:<br>
        <br>
        username@computername:~$ ls ~/phonopy-1.10.0/lib/python/phonopy<br>
        api_gruneisen.py   api_qha.pyc  harmonic      _phonopy.so 
        units.pyc<br>
        api_gruneisen.pyc  cui          __init__.py   qha         
        version.py<br>
        api_phonopy.py     file_IO.py   __init__.pyc  _spglib.so  
        version.pyc<br>
        api_phonopy.pyc    file_IO.pyc  interface     structure<br>
        api_qha.py         gruneisen    phonon        units.py<br>
        <br>
        In the error message, it looks like it is pointing to the wrong
        location (/home/IITJHOME/ambeshst/win2k13mpi/phonopy), when it
        should be pointing to
        "/home/IITJHOME/ambeshst/win2k13mpi/phonopy-1.10.0/lib64/python".<br>
        <br>
        Do "echo $PYTHONPATH", is it pointing to the right location?<br>
        <br>
        On my system, it is pointing to
        "/home/username/phonopy-1.10.0/lib/python":<br>
        <br>
        username@computername:~$ echo $PYTHONPATH<br>
        :/home/username/phonopy-1.10.0/lib/python<br>
        <br>
        After adding export lines to .bashrc and saving the changes, did
        you reload the .bashrc (using "source ~/.bashrc" or open and use
        a new terminal)?<br>
        <br>
        On 2/16/2016 2:49 AM, Rajneesh Chaurasiya wrote:<br>
      </div>
      <blockquote
cite="mid:CAOsEhO9w0vYO0BBU-zZ1OgXbSKM8efe4OC6NqcDHwiNKGkWBaw@mail.gmail.com"
        type="cite">
        <div dir="ltr">
          <div>
            <div>I have modified the file according to your suggestion
              but still there is same error...<br>
              <br>
              Traceback (most recent call last):<br>
                File "/home/IITJHOME/ambeshst/win2k13mpi/phonopy", line
              40, in ?<br>
                  from phonopy import *<br>
              ImportError: No module named phonopy<br>
              <br>
              <br>
            </div>
            I am attaching the .bashrc file so please check whether this
            is correct or not..<br>
          </div>
          please suggest your suggestion..<br>
          <div>
            <div><br>
            </div>
          </div>
        </div>
        <div class="gmail_extra"><br>
          <div class="gmail_quote">On Sat, Feb 13, 2016 at 12:38 PM,
            Rajneesh Chaurasiya <span dir="ltr"><<a
                moz-do-not-send="true" class="moz-txt-link-abbreviated"
                href="mailto:rajnano2012@gmail.com"><a class="moz-txt-link-abbreviated" href="mailto:rajnano2012@gmail.com">rajnano2012@gmail.com</a></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"><br clear="all">
                <br>
                Dear Gavin,<br>
                <br>
                I have installed newer version of phonopy package <a
                  moz-do-not-send="true" class="moz-txt-link-freetext"
href="https://sourceforge.net/projects/phonopy/files/phonopy/phonopy-1.10/phonopy-1.10.0.tar.gz/download"><a class="moz-txt-link-freetext" href="https://sourceforge.net/projects/phonopy/files/phonopy/phonopy-1.10/phonopy-1.10.0.tar.gz/download">https://sourceforge.net/projects/phonopy/files/phonopy/phonopy-1.10/phonopy-1.10.0.tar.gz/download</a></a>
                and it required the scf2forces which i get from <a
                  moz-do-not-send="true" class="moz-txt-link-freetext"
                  href="http://www.wien2k.at/reg_user/unsupported/"><a class="moz-txt-link-freetext" href="http://www.wien2k.at/reg_user/unsupported/">http://www.wien2k.at/reg_user/unsupported/</a></a>
                but it showing the error, which i have seen in the
                previous message. but as per your suggestion if i use he
                experimental support option in Phonopy 1.10.0 [ <a
                  moz-do-not-send="true" class="moz-txt-link-freetext"
                  href="http://atztogo.github.io/phonopy/wien2k.html#wien2k-interface"><a class="moz-txt-link-freetext" href="http://atztogo.github.io/phonopy/wien2k.html#wien2k-interface">http://atztogo.github.io/phonopy/wien2k.html#wien2k-interface</a></a>
                ]: means phonopy --wien2k -f case-001.scf case-002.scf
                then it showing error some error.<br>
                <br>
                <br>
                Traceback (most recent call last):<br>
                  File "/home/IITJHOME/ambeshst/win2k13mpi/phonopy",
                line 40, in ?<br>
                    from phonopy import *<br>
                ImportError: No module named phonopy<br>
                <br>
                <br>
                 so i dont know that the installed phonopy is compatible
                with the wien2k or not.<br>
                <br>
                please give me your ideas why this is happening. <br>
              </div>
            </blockquote>
          </div>
          <br>
          <br clear="all">
          <br>
          -- <br>
          <div class="gmail_signature">
            <div dir="ltr">
              <div>
                <div dir="ltr">Thanks & Regards
                  <div>Rajneesh Chaurasiya</div>
                  <div>Junior Research Fellow</div>
                  <div>ABV-IIITM, Gwalior, India<br>
                  </div>
                  <div>Mob. No. +91-9584499697<br>
                                  +91-8435727031<br>
                  </div>
                </div>
              </div>
            </div>
          </div>
        </div>
      </blockquote>
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      <br>
      <pre wrap="">_______________________________________________
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</pre>
    </blockquote>
    <br>
    <pre class="moz-signature" cols="72">-- 
ir. Michael Sluydts
Center for Molecular Modeling
Ghent University
Technologiepark 903
9052 Zwijnaarde, Belgium
tel. +32 (0)9 264 66 19
<a class="moz-txt-link-freetext" href="https://molmod.ugent.be">https://molmod.ugent.be</a>
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