<div dir="ltr">Hi Suza,<div><br></div><div style> You can't tell the types of pseudopotentials just according to the valence electrons. Actually, the valence electron numbers should be same for all the pseudopotentials.</div>
<div style><br></div><div style>Cheers,</div><div style>Yun </div></div><div class="gmail_extra"><br><br><div class="gmail_quote">On Mon, Apr 22, 2013 at 11:22 PM, Suza W <span dir="ltr"><<a href="mailto:suza.rri@gmail.com" target="_blank">suza.rri@gmail.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><pre>Dear All,
Could you anyone please send me the following pseudopotentials (USPP or PAW or NC) ?
(a) LDA for Barium(Ba) with 6s-5p-5s-4d (total 20 electrons) in valence; and (b) LDA-USPP for Zinc (Zn) with 4s2 (only 2 electrons) in valence.
Thanks and regards, <br>Suza<br></pre><br>
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<p>Dr. Yun Wang<br>Research Fellow<br>Centre for Clean Environment and Energy<br>Griffith School of Environment<br>Gold Coast Campus, Griffith University<br>QLD 4222, Australia<br>Tel:(61-7) 5552 8456<br>Fax:(61-7) 5552 8067</p>
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