ADVANCED

 

PSEUDOPOTENTIALS

 

 

for

 

Large Scale Electronic Structure Calculations

 

 

With Application to A Study of Weakly Ordered Material - g-Al2O3

 

 

 

Ming-Hsien Lee

 

Clare College, University of Cambridge

 

 

 

 

 

 

 

 

 

 

 

A Ph.D. Thesis of The University of Cambridge