Dear Axel,<br><div class="im">> Is the option 'stm_wfc_matching' operational in post processing? In<br>
> 3.2.3 version, it says that stm_wfc_matching is presently disabled. In<br>
> 4.0 version, it doesn't say anything, so I guess it should be working<br>
<br>
</div>why?<br><br>In the version 3.2.3, it is clearly stated that 'stm_wfc_matching is presently disabled'. When the version changes to 4.0, why would one remove something which is informative and still holds true?<br>
<br>'does not work' could as well mean that it does not work for this particular system!<br><br>Many thanks for your answer.<br><br>Pushpa<br><br><br><br><br><div class="gmail_quote">On Sun, May 31, 2009 at 3:23 PM, Axel Kohlmeyer <span dir="ltr"><<a href="mailto:akohlmey@cmm.chem.upenn.edu">akohlmey@cmm.chem.upenn.edu</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="border-left: 1px solid rgb(204, 204, 204); margin: 0pt 0pt 0pt 0.8ex; padding-left: 1ex;">On Sun, 2009-05-31 at 13:52 -0700, pushpa raghani wrote:<br>
> Hi,<br>
<br>
dear pushpa,<br>
<div class="im"><br>
> Is the option 'stm_wfc_matching' operational in post processing? In<br>
> 3.2.3 version, it says that stm_wfc_matching is presently disabled. In<br>
> 4.0 version, it doesn't say anything, so I guess it should be working<br>
<br>
</div>why?<br>
<div class="im"><br>
> there? However, I get the error 'option stm_wfc_matching does not<br>
> work'. I tried this both on symmetric and asymmetric slab. Any ideas?<br>
<br>
</div>well, the "does not work" should give you an answer. i don't really<br>
now about the code in question, but if you see messages like that, it<br>
usually means that the code is either partially implemented or has<br>
some know bugs or something else that can only be fixed by somebody<br>
carefully looking at the implementation.<br>
<br>
cheers,<br>
axel.<br>
<div class="im"><br>
> Many Thanks,<br>
> Pushpa<br>
> (Stanford University)<br>
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Axel Kohlmeyer <a href="mailto:akohlmey@cmm.chem.upenn.edu">akohlmey@cmm.chem.upenn.edu</a> <a href="http://www.cmm.upenn.edu" target="_blank">http://www.cmm.upenn.edu</a><br>
Center for Molecular Modeling -- University of Pennsylvania<br>
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tel: 1-215-898-1582, fax: 1-215-573-6233, office-tel: 1-215-898-5425<br>
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If you make something idiot-proof, the universe creates a better idiot.<br>
<br>
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