Experimental and density functional theory study of the influence mechanism of oxygen on NO heterogeneous reduction in deep air-staged combustion

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Vol 223 ◽  
pp. 127-141
Author(s):  
Ping Chen ◽  
Mingyan Gu ◽  
Dongfang Wang ◽  
Jialun Wang ◽  
Xiangyong Huang ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
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Density Functional Theory Study ◽  
Staged Combustion ◽  
Functional Theory ◽  
Influence Mechanism ◽  
Heterogeneous Reduction

Binuclear ethylenedithiolate iron carbonyls: A density functional theory study

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Author(s):  
Luana-Flavia Radu ◽  
Amr A.A. Attia ◽  
Radu Silaghi-Dumitrescu ◽  
Alexandru Lupan ◽  
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Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Iron Carbonyls
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