Ab Initio Calculation of the Electronic Absorption of Functionalized Octahedral Silsesquioxanes via Time-Dependent Density Functional Theory with Range-Separated Hybrid Functionals

2012 ◽  
Vol 116 (4) ◽  
pp. 1137-1145 ◽  
Author(s):  
Heidi Phillips ◽  
Shaohui Zheng ◽  
Alexander Hyla ◽  
Richard Laine ◽  
Theodore Goodson ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Ab Initio ◽  
Electronic Absorption ◽  
Ab Initio Calculation ◽  
Density Functional ◽  
Time Dependent ◽  
Functional Theory ◽  
Hybrid Functionals ◽  
Dependent Density

Ab Initio Computational Approach for Nanophotonics Based on Time-Dependent Density Functional Theory

2021 ◽  
pp. 103-133
Author(s):  
Kazuhiro Yabana ◽  
Takashi Takeuchi ◽  
Mitsuharu Uemoto ◽  
Atsushi Yamada ◽  
Shunsuke Yamada
Keyword(s):  
Density Functional Theory ◽  
Ab Initio ◽  
Density Functional ◽  
Computational Approach ◽  
Time Dependent ◽  
Functional Theory ◽  
Dependent Density
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