Exploring the role of varied-length spacers in charge transfer: a theoretical investigation on pyrimidine-bridged porphyrin dyes

RSC Advances ◽  
2013 ◽  
Vol 3 (38) ◽  
pp. 17515 ◽  
Author(s):  
Meiyuan Guo ◽  
Ming Li ◽  
Yulan Dai ◽  
Wei Shen ◽  
Jingdong Peng ◽  
...  
Keyword(s):  
Charge Transfer ◽  
Theoretical Investigation

Theoretical Investigation of Singlet Fission in Molecular Dimers: The Role of Charge Transfer States and Quantum Interference

2014 ◽  
Vol 118 (26) ◽  
pp. 14192-14199 ◽  
Author(s):  
Fatemeh Mirjani ◽  
Nicolas Renaud ◽  
Natalie Gorczak ◽  
Ferdinand C. Grozema
Keyword(s):  
Charge Transfer ◽  
Theoretical Investigation ◽  
Quantum Interference ◽  
Singlet Fission

Dynamic adjustment of emission from both singlets and triplets: the role of excited state conformation relaxation and charge transfer in phenothiazine derivates

2021 ◽  
Author(s):  
Weidong Qiu ◽  
Xinyi Cai ◽  
Mengke Li ◽  
Liangying Wang ◽  
Yanmei He ◽  
...  
Keyword(s):  
Excited State ◽  
Charge Transfer ◽  
Intramolecular Charge Transfer ◽  
Dynamic Adjustment ◽  
Twisted Intramolecular Charge Transfer

Dynamic adjustment of emission behaviours by controlling the extent of twisted intramolecular charge transfer character in excited state.

Role of non-covalent interactions in the supramolecular architectures of mercury(ii) diphenyldithiophosphates: An experimental and theoretical investigation

2021 ◽  
Vol 45 (4) ◽  
pp. 2249-2263
Author(s):  
Pretam Kumar ◽  
Snehasis Banerjee ◽  
Anu Radha ◽  
Tahira Firdoos ◽  
Subash Chandra Sahoo ◽  
...  
Keyword(s):  
Theoretical Investigation ◽  
Supramolecular Organization ◽  
Π Interactions ◽  
Supramolecular Architectures ◽  
Non Covalent Interactions ◽  
Covalent Interactions

The H-bond, spodium bond and CH⋯π interactions playing an important role in the supramolecular organization of two mercury(ii) diphenyldithiophosphate complexes have been discussed.

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