Optical Properties of Monolayer-Protected Aluminum Clusters: Time-Dependent Density Functional Theory Study

2015 ◽  
Vol 119 (33) ◽  
pp. 19539-19547 ◽  
Author(s):  
Johan Lindgren ◽  
Andre Clayborne ◽  
Lauri Lehtovaara
Keyword(s):  
Density Functional Theory ◽  
Optical Properties ◽  
Density Functional ◽  
Time Dependent ◽  
Density Functional Theory Study ◽  
Aluminum Clusters ◽  
Functional Theory ◽  
Dependent Density

Optical properties of pure graphene in various forms: a time dependent density functional theory study

RSC Advances ◽  
2014 ◽  
Vol 4 (92) ◽  
pp. 50606-50613 ◽  
Author(s):  
S. Chopra ◽  
L. Maidich
Keyword(s):  
Density Functional Theory ◽  
Optical Properties ◽  
Optical Absorption ◽  
Oscillator Strength ◽  
Density Functional ◽  
Time Dependent ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Dependent Density

Optical absorption in graphene nano-ribbons (GNRs) of various shapes and isomeric forms was studied using time dependent density functional theory based calculations. The highest oscillator strength was found for rectangular GNRs.

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