[Wien] Improving vacuum basis set

[Laurence Marks]

I am running in to some issues with electrons at some distance from a
surface, and I suspect that I might not have the best basis set for
these in a conventional calculation. I'm wondering if anyone has
thought about this problem and come up with some ideas to try.

-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
http://www.numis.northwestern.edu