The effect of palladium clusters (Pdn, n=2–8) on mechanisms of acetylene hydrogenation: A DFT study

2012 ◽  
Vol 359 ◽  
pp. 14-20 ◽  
Author(s):  
Jun-Nan Li ◽  
Min Pu ◽  
Chi-Cheng Ma ◽  
Ye Tian ◽  
Jing He ◽  
...  
Keyword(s):  
Dft Study ◽  
Acetylene Hydrogenation ◽  
Palladium Clusters

Growth of sub-nanometric palladium clusters on boron nitride nanotubes: a DFT study

2016 ◽  
Vol 18 (3) ◽  
pp. 1750-1757 ◽  
Author(s):  
Roberto Schimmenti ◽  
Remedios Cortese ◽  
Francesco Ferrante ◽  
Antonio Prestianni ◽  
Dario Duca
Keyword(s):  
Boron Nitride ◽  
Boron Nitride Nanotubes ◽  
Dft Study ◽  
Palladium Clusters

Boron nitride nanotubes as a template for the growth of sub-nanometric palladium clusters.

The kinetic mechanism of acetylene hydrogenation to prepare ethane over FexOy clusters: A DFT study

2021 ◽  
Vol 230 ◽  
pp. 116170
Author(s):  
Ren Feng ◽  
Lun Pan ◽  
Fengwu Li ◽  
Daidi Xu ◽  
Ronghui Shi ◽  
...  
Keyword(s):  
Kinetic Mechanism ◽  
Dft Study ◽  
Acetylene Hydrogenation

The effect of interstitial boron on the mechanisms of acetylene hydrogenation catalyzed by Pd6: A DFT study

2019 ◽  
Vol 1170 ◽  
pp. 112636
Author(s):  
Jianfeng Wang ◽  
Wenshu Hao ◽  
Li-Juan Ma ◽  
Jianfeng Jia ◽  
Hai-Shun Wu
Keyword(s):  
Dft Study ◽  
Acetylene Hydrogenation

The Dopant Aluminum Enhances CO Oxidation Catalyzed by Subnanometer Small Palladium Clusters: A DFT Study

2016 ◽  
Vol 52 (2) ◽  
pp. 199-210
Author(s):  
Zhaoru Cao ◽  
Ling Guo ◽  
Ningning Ren ◽  
Naying Liu ◽  
Wenli Li ◽  
...  
Keyword(s):  
Co Oxidation ◽  
Dft Study ◽  
Palladium Clusters

DFT study of the effect of hidrocarbonated chains on the electronic properties of some oligothiophene derivatives

2009 ◽  
Author(s):  
Manuel Fernández-Gómez ◽  
Amparo Navarro ◽  
MªPaz Fernández-Liencres ◽  
Mónica Moral ◽  
José Manuel Granadino-Roldán ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Dft Study
Sign in / Sign up

Export Citation Format

Share Document