Correlation effects and excited states in conjugated polymers

1986 ◽  
Vol 34 (8) ◽  
pp. 5484-5497 ◽  
Author(s):  
G. W. Hayden ◽  
E. J. Mele
Keyword(s):  
Conjugated Polymers ◽  
Excited States ◽  
Correlation Effects

Embracing local suppression and enhancement of dynamic correlation effects in a CASΠDFT method for efficient description of excited states

2020 ◽  
Vol 224 ◽  
pp. 333-347
Author(s):  
Katarzyna Pernal ◽  
Oleg V. Gritsenko
Keyword(s):  
Excited States ◽  
Correlation Energy ◽  
Correlation Effects ◽  
Dynamic Correlation

In this work we show that the presence of covalent and ionic configurations in a wavefunction gives rise to spatial regions where the effects of suppression and enhancement of correlation energy, respectively, dominate.

Correlation Effects in EOM-CCSD for the Excited States:  Evaluated by AIM Localization Index (LI) and Delocalization Index (DI)

2007 ◽  
Vol 111 (18) ◽  
pp. 3592-3601 ◽  
Author(s):  
Yi-Gui Wang ◽  
Kenneth B. Wiberg ◽  
Nick H. Werstiuk
Keyword(s):  
Excited States ◽  
Correlation Effects ◽  
Localization Index ◽  
Delocalization Index

Correlation effects on the scattering of soliton pairs in conjugated polymers

2012 ◽  
Vol 100 (5) ◽  
pp. 57005 ◽  
Author(s):  
Hui Zhao ◽  
Yuguang Chen ◽  
Yonghong Yan ◽  
Zhong An ◽  
Changqin Wu
Keyword(s):  
Conjugated Polymers ◽  
Correlation Effects

Systematic characterization of excited states in conjugated polymers

1997 ◽  
Vol 85 (1-3) ◽  
pp. 1001-1006 ◽  
Author(s):  
M. Chandross ◽  
Y. Shimoi ◽  
S. Mazumdar
Keyword(s):  
Conjugated Polymers ◽  
Excited States

Correlation effects in the excited states of polydiacetylene models

1982 ◽  
Vol 88 (2) ◽  
pp. 171-176 ◽  
Author(s):  
Uri Dinur ◽  
Martin Karplus
Keyword(s):  
Excited States ◽  
Correlation Effects

Correlation effects in doubly excited states of positive ions

1993 ◽  
Vol 26 (20) ◽  
pp. 3515-3530
Author(s):  
I K Dmitrieva ◽  
G I Plindov ◽  
S K Pogrebnya
Keyword(s):  
Excited States ◽  
Correlation Effects ◽  
Doubly Excited States ◽  
Positive Ions ◽  
Doubly Excited

Time resolved charge carrier generation from higher lying excited states in conjugated polymers

2003 ◽  
Vol 137 (1-3) ◽  
pp. 1457-1458
Author(s):  
C. Gadermaier ◽  
G. Cerullo ◽  
G. Sansone ◽  
U. Scherf ◽  
G. Lanzani
Keyword(s):  
Charge Carrier ◽  
Conjugated Polymers ◽  
Excited States ◽  
Carrier Generation ◽  
Time Resolved

Systematic characterization of excited states in π-conjugated polymers

1997 ◽  
Vol 280 (1-2) ◽  
pp. 85-90 ◽  
Author(s):  
M. Chandross ◽  
Y. Shimoi ◽  
S. Mazumdar
Keyword(s):  
Conjugated Polymers ◽  
Excited States
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