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They look reasonable to me ... <br>
but you can check that lattice parameter, interlayer surface
relaxation, or bond length in Cu2 dimer are ok to have some feeling
that the pseudopotentials are working properly.<br>
<br>
stefano<br>
<br>
On 03/31/2011 11:26 PM, Izaak Williamson wrote:
<blockquote cite="mid:562843.64501.qm@web43413.mail.sp1.yahoo.com"
type="cite">
<pre wrap="">Dear Stefano,
I plotted the average charge and it seems reasonable to me for both the
pseudopotentials. I am attaching both plots, it would be nice to get your input.
Thank you.
</pre>
<pre wrap="">
<fieldset class="mimeAttachmentHeader"></fieldset>
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