Abstract
A nonlocal pseudopotential procedure has been utilized to obtain the conduction electron wave functions in magnesium metal. It is found that the use of these wave functions along with a finer scanning of the Fermi surface, namely, 110 points in of the Brillouin zone, leads to a value for the Knight shift in much better agreement with experiment than was an earlier value obtained by the orthogonalized-plane-wave procedure. Possible sources for the difference in theoretical values obtained by using these two different procedures are discussed. Improved values of the relaxation time and Korringa constant are also presented.
- Received 21 January 1970
DOI:https://doi.org/10.1103/PhysRevB.2.2264
©1970 American Physical Society