Density Functional Theory Applied to Pt and Pt Alloy Clusters and Adsorbate

2001 ◽  
Author(s):  
Eugine Smotkin
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Functional Theory ◽  
Pt Alloy ◽  
Alloy Clusters

On the structure and reactivity of PtnCun (n = 1–7) alloy clusters

2021 ◽  
Vol 23 (12) ◽  
pp. 7233-7239
Author(s):  
Peter L. Rodríguez-Kessler ◽  
Adán R. Rodríguez-Domínguez ◽  
Alvaro Muñoz-Castro
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Functional Theory ◽  
Alloy Clusters

The structure, electronic and reactivity properties of PtnCun (n = 1–7) clusters are investigated in the framework of density functional theory (DFT).

Theoretical studies of the adsorption of hydroxymethylidyne (COH) on Pt-alloy surfaces using density functional theory

2016 ◽  
Vol 91 (2) ◽  
pp. 025803 ◽  
Author(s):  
Wahyu Tri Cahyanto ◽  
Wahyu Widanarto ◽  
Ganes Shukri ◽  
Hideaki Kasai
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Theoretical Studies ◽  
Functional Theory ◽  
Pt Alloy

Density functional theory study of ZnnInn (n = 2–10) alloy clusters

2022 ◽  
Vol 1247 ◽  
pp. 131345
Author(s):  
Wenjing Wang ◽  
Yong Deng ◽  
Xiumin Chen ◽  
Xuquan Wang ◽  
Zhongqian Zhao ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Alloy Clusters
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