Basis functions for arbitrary cells in multiple-scattering theory

1993 ◽  
Vol 48 (4) ◽  
pp. 2118-2130 ◽  
Author(s):  
W. H. Butler ◽  
A. Gonis ◽  
X.-G. Zhang
1991 ◽  
Vol 253 ◽  
Author(s):  
Xindong Wang ◽  
X. -G. Zhang ◽  
W. H. Butler ◽  
B. N. Harmon ◽  
G. M. Stocks

ABSTRACTWe derive a relativistic full potential multiple scattering theory (MST) in direct analog to the non-relativistic full potential MST[1, 2]. The secular equation is derived fromi the Lippmann-Schwinger equation by expanding the wave function in terms of cell basis functions which are locally exact solutions of the Dirac equation. The relationship between this theory and currently widely used relativistic munffin-tin MST is also discussed.


1992 ◽  
Vol 46 (12) ◽  
pp. 7433-7447 ◽  
Author(s):  
X.-G. Zhang ◽  
W. H. Butler

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