<br clear="all">Dear Everyone,<br> I've been tryign to generate an US PP for cesium. And I have built various input files ( as in the attachment is one of them), after running PP generation I do the plot for matching AE and pseudo wave functions and logarithmic derivative ( I also enclosed the plots in the files). The wave function matching seem correct but the ld ones do not match. I have tried with different rcut and rcutus values for each valence states but the results turned out to be similar to the one in the files. And I have been able to find anyone that have generated the US PP for Cs but norm-conserving PP. Would you give me some insights on what I might have done wrong in my input file ? and is it possible to generate the US PP for cesium?<br>
<br>Regards,<br><br>Tram Bui<br><br>M.S. Materials Science & Engineering<br><a href="mailto:trambui@u.boisestate.edu" target="_blank">trambui@u.boisestate.edu</a><br><br>