The paper I am referring to is: C.Y. Lin, B.A. Jones, Phys Rev B 83, 014413 (2011).
They perform an all-electron calculation and find that one electron is forfeit to the surface (so Co has a + charge), yet they still find the spin to be 3/2. When I use pseudopotential calculations on the same system, I get a similar charge (forfeiting one electron to the surface) but my spin is 1. How can this be? -- Izaak Williamson Research Assistant Physics Department Boise State University -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110811/2ee48730/attachment.htm
