hi, how can i tell the core radius ( cuttoff radius) , r_c , at which a pseudo potential is valid? ir for something like B.pz-vbc.UPF, how can i find out from which values the pseudo matches the *real* wavefunction?
Regards M. O. ATAMBO. Undergrad , Moi University Chepkoilel University college Kenya. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110322/3ba08cc2/attachment.htm
