scholarly journals Electronic couplings and rates of excited state charge transfer processes at poly(thiophene-co-quinoxaline)–PC71BM interfaces: two- versus multi-state treatments

2019 ◽  
Vol 21 (46) ◽  
pp. 25606-25625
Author(s):  
Tuuva Kastinen ◽  
Demetrio Antonio da Silva Filho ◽  
Lassi Paunonen ◽  
Mathieu Linares ◽  
Luiz Antonio Ribeiro Junior ◽  
...  

Multi-state effects should be considered when calculating electronic couplings at local polymer–fullerene interfaces with the non-tuned and optimally tuned long-range corrected functionals.

2021 ◽  
Author(s):  
Mandeep K. Chahal ◽  
Anuradha Liyanage ◽  
Ajyal Z. Alsaleh ◽  
Paul A. Karr ◽  
Jonathan P. Hill ◽  
...  

A new type of push–pull charge transfer complex, viz., a spiro-locked N-heterocycle-fused zinc porphyrin, ZnP-SQ, is shown to undergo excited state charge separation, which is enhanced by axial F− binding to the Zn center.


ACS Nano ◽  
2015 ◽  
Vol 9 (7) ◽  
pp. 7175-7185 ◽  
Author(s):  
Giriraj Jnawali ◽  
Yi Rao ◽  
Jonathan H. Beck ◽  
Nicholas Petrone ◽  
Ioannis Kymissis ◽  
...  

2018 ◽  
Vol 8 (11) ◽  
pp. 3262 ◽  
Author(s):  
Si-Qiu Li ◽  
Cheng-Bao Yao ◽  
Yu Cai ◽  
Yue Han ◽  
Ke-Xin Zhang ◽  
...  

2019 ◽  
Vol 131 (13) ◽  
pp. 4394-4399 ◽  
Author(s):  
Rekha Sharma ◽  
Michael B. Thomas ◽  
Rajneesh Misra ◽  
Francis D'Souza

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