The Role of Ab Initio Electronic Structure Calculations in Contemporary Materials Science

2002 ◽  
Vol 227 ◽  
pp. 261-0 ◽  
Author(s):  
Mojmír Šob ◽  
M. Friák ◽  
L.G. Wang ◽  
V. Vitek
Keyword(s):  
Electronic Structure ◽  
Ab Initio ◽  
Materials Science ◽  
Electronic Structure Calculations ◽  
Structure Calculations ◽  
Ab Initio Electronic Structure

Ab initio electronic structure calculations and optical properties of ordered and disordered Ni3Al

2011 ◽  
Vol 509 (17) ◽  
pp. 5230-5237 ◽  
Author(s):  
Altaf Hussain ◽  
Sitaram Aryal ◽  
Paul Rulis ◽  
M. Arshad Choudhry ◽  
Jun Chen ◽  
...  
Keyword(s):  
Optical Properties ◽  
Electronic Structure ◽  
Ab Initio ◽  
Electronic Structure Calculations ◽  
Structure Calculations ◽  
Ab Initio Electronic Structure
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