Assembly effect on the charge carrier mobility in quaterthiophene-based n/p-materials

2019 ◽  
Vol 7 (22) ◽  
pp. 6649-6655
Author(s):  
A. López-Andarias ◽  
C. Atienza ◽  
J. López-Andarias ◽  
W. Matsuda ◽  
T. Sakurai ◽  
...  

Effect of the peptide-based quaterthiophene self-assembly process on the charge mobility properties of the n/p-materials formed is studied.

2018 ◽  
Author(s):  
Francesco Salerno ◽  
Beth Rice ◽  
Julia Schmidt ◽  
Matthew J. Fuchter ◽  
Jenny Nelson ◽  
...  

<p>The properties of an organic semiconductor are dependent on both the chemical structure of the molecule involved, and how it is arranged in the solid-state. It is challenging to extract the influence of each individual factor, as small changes in the molecular structure often dramatically change the crystal packing and hence solid-state structure. Here, we use calculations to explore the influence of the nitrogen position on the charge mobility of a chiral organic molecule when the crystal packing is kept constant. The transfer integrals for a series of enantiopure aza[6]helicene crystals sharing the same packing were analysed in order to identify the best supramolecular motifs to promote charge carrier mobility. The regioisomers considered differ only in the positioning of the nitrogen atom in the aromatic scaffold. The simulations showed that even this small change in the chemical structure has a strong effect on the charge transport in the crystal, leading to differences in charge mobility of up to one order of magnitude. Some aza[6]helicene isomers that were packed interlocked with each other showed high HOMO-HOMO integrals (up to 70 meV), whilst molecules arranged with translational symmetry generally afforded the highest LUMO-LUMO integrals (40 - 70 meV). As many of the results are not intuitively obvious, a computational approach provides additional insight into the design of new semiconducting organic materials.</p>


2017 ◽  
Vol 5 (3) ◽  
pp. 669-682 ◽  
Author(s):  
Ke-Qing Zhao ◽  
Min Jing ◽  
Ling-Ling An ◽  
Jun-Qi Du ◽  
Yan-Hong Wang ◽  
...  

Searching for new organic, mesomorphic semiconductors is essential for the development of applications in the emerging field of molecular electronics.


2019 ◽  
Vol 7 (40) ◽  
pp. 12463-12469 ◽  
Author(s):  
Jingze Bi ◽  
Hao Wu ◽  
Zhenhu Zhang ◽  
Ao Zhang ◽  
Huanzhi Yang ◽  
...  

A series of triphenylene esters with two ester groups at different substituent positions was synthesized and investigated. 3,6-substituted molecule formed a helical hexagonal columnar superstructure, leading to improved charge carrier mobility.


2012 ◽  
Vol 22 (30) ◽  
pp. 15235 ◽  
Author(s):  
Nagesh B. Kolhe ◽  
R. Nandini Devi ◽  
Satyaprasad P. Senanayak ◽  
B. Jancy ◽  
K. S. Narayan ◽  
...  

2018 ◽  
Author(s):  
Francesco Salerno ◽  
Beth Rice ◽  
Julia Schmidt ◽  
Matthew J. Fuchter ◽  
Jenny Nelson ◽  
...  

<p>The properties of an organic semiconductor are dependent on both the chemical structure of the molecule involved, and how it is arranged in the solid-state. It is challenging to extract the influence of each individual factor, as small changes in the molecular structure often dramatically change the crystal packing and hence solid-state structure. Here, we use calculations to explore the influence of the nitrogen position on the charge mobility of a chiral organic molecule when the crystal packing is kept constant. The transfer integrals for a series of enantiopure aza[6]helicene crystals sharing the same packing were analysed in order to identify the best supramolecular motifs to promote charge carrier mobility. The regioisomers considered differ only in the positioning of the nitrogen atom in the aromatic scaffold. The simulations showed that even this small change in the chemical structure has a strong effect on the charge transport in the crystal, leading to differences in charge mobility of up to one order of magnitude. Some aza[6]helicene isomers that were packed interlocked with each other showed high HOMO-HOMO integrals (up to 70 meV), whilst molecules arranged with translational symmetry generally afforded the highest LUMO-LUMO integrals (40 - 70 meV). As many of the results are not intuitively obvious, a computational approach provides additional insight into the design of new semiconducting organic materials.</p>


2018 ◽  
Vol 20 (23) ◽  
pp. 15970-15979 ◽  
Author(s):  
M. Alkan ◽  
I. Yavuz

Longer alkyl side-chains in BTBTs regulate structural order, cause balanced transport and lead to enhanced intrinsic charge-carrier mobility.


2014 ◽  
Vol 50 (38) ◽  
pp. 4955-4958 ◽  
Author(s):  
D. Deniz Günbaş ◽  
Chenming Xue ◽  
Sameer Patwardhan ◽  
Maria C. Fravventura ◽  
Hao Zhang ◽  
...  

In this communication we report on the synthesis and charge mobility of highly soluble perylenebisimid derivatives.


2019 ◽  
Vol 7 (45) ◽  
pp. 14394-14394
Author(s):  
Jingze Bi ◽  
Hao Wu ◽  
Zhenhu Zhang ◽  
Ao Zhang ◽  
Huanzhi Yang ◽  
...  

Correction for ‘Highly ordered columnar superlattice nanostructures with improved charge carrier mobility by thermotropic self-assembly of triphenylene-based discotics’ by Jingze Bi et al., J. Mater. Chem. C, 2019, 7, 12463–12469.


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