Density Functional Theory Study of Carboxylic Acids Adsorption and Enolization on Monoclinic Zirconia Surfaces

2011 ◽  
Vol 115 (32) ◽  
pp. 16012-16018 ◽  
Author(s):  
Alexey V. Ignatchenko
Keyword(s):  
Density Functional Theory ◽  
Carboxylic Acids ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Monoclinic Zirconia ◽  
Functional Theory

Density Functional Theory Study on the Interactions of Metal Ions with Long Chain Deprotonated Carboxylic Acids

2015 ◽  
Vol 119 (40) ◽  
pp. 10195-10203 ◽  
Author(s):  
Aleksandar Y. Mehandzhiyski ◽  
Enrico Riccardi ◽  
Titus S. van Erp ◽  
Henrik Koch ◽  
Per-Olof Åstrand ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Metal Ions ◽  
Carboxylic Acids ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Long Chain
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