Reaction Intermediates of CO Oxidation on Gas Phase Pd4Clusters: A Density Functional Study

2009 ◽  
Vol 131 (37) ◽  
pp. 13252-13254 ◽  
Author(s):  
Bulumoni Kalita ◽  
Ramesh C. Deka
Keyword(s):  
Co Oxidation ◽  
Gas Phase ◽  
Density Functional ◽  
Functional Study ◽  
Reaction Intermediates ◽  
Density Functional Study

scholarly journals Density functional study on the CO oxidation reaction mechanism on MnN2-doped graphene

RSC Advances ◽  
2020 ◽  
Vol 10 (46) ◽  
pp. 27856-27863
Author(s):  
Mingming Luo ◽  
Zhao Liang ◽  
Chao Liu ◽  
Xiaopeng Qi ◽  
Mingwei Chen ◽  
...  
Keyword(s):  
Reaction Mechanism ◽  
Co Oxidation ◽  
Oxidation Reaction ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study ◽  
Co Oxidation Reaction ◽  
Doped Graphene ◽  
First Time

The various COOR mechanisms on MnN2-doped graphene (MnN2C2: MnN2C2-hex, MnN2C2-opp, MnN2C2-pen) were investigated for the first time.

Oxidation of small gas phase Pd clusters: A density functional study

2006 ◽  
Vol 35 (3) ◽  
pp. 371-374 ◽  
Author(s):  
Bernd Huber ◽  
Hannu Häkkinen ◽  
Uzi Landman ◽  
Michael Moseler
Keyword(s):  
Gas Phase ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study ◽  
Pd Clusters

Density Functional Study on the Mechanisms of the Reactions of Gas-Phase OsOn+(n= 1−4) with Methane

2004 ◽  
Vol 23 (15) ◽  
pp. 3656-3667 ◽  
Author(s):  
Ganbing Zhang ◽  
Shuhua Li ◽  
Yuansheng Jiang
Keyword(s):  
Gas Phase ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study
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