Charge separation and covalent bonding in metal oxide surfaces: A local density functional study on the MgO(001) surface

1994 ◽  
Vol 100 (9) ◽  
pp. 6826-6836 ◽  
Author(s):  
U. Birkenheuer ◽  
J. C. Boettger ◽  
N. Rösch
Keyword(s):  
Metal Oxide ◽  
Charge Separation ◽  
Density Functional ◽  
Local Density ◽  
Covalent Bonding ◽  
Functional Study ◽  
Oxide Surfaces ◽  
Density Functional Study ◽  
Metal Oxide Surfaces ◽  
Local Density Functional

Metal/conjugated polymer interfaces: A local density functional study of aluminum/polyene interactions

1994 ◽  
Vol 100 (12) ◽  
pp. 9258-9264 ◽  
Author(s):  
C. Fredriksson ◽  
R. Lazzaroni ◽  
J. L. Brédas ◽  
A. Ouhlal ◽  
A. Selmani
Keyword(s):  
Conjugated Polymer ◽  
Density Functional ◽  
Local Density ◽  
Functional Study ◽  
Polymer Interfaces ◽  
Density Functional Study ◽  
Local Density Functional
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