Inverse Design of Tetracene Polymorphs with Enhanced Singlet Fission Performance by Property-Based Genetic Algorithm Optimization

[Image: see text] The efficiency of solar cells may be improved by using singlet fission (SF), in which one singlet exciton splits into two triplet excitons. SF occurs in molecular crystals. A molecule may crystallize in more than one form, a phenomenon known as polymorphism. Crystal structure may a...

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Detalles Bibliográficos
Autores principales: Tom, Rithwik, Gao, Siyu, Yang, Yi, Zhao, Kaiji, Bier, Imanuel, Buchanan, Eric A., Zaykov, Alexandr, Havlas, Zdeněk, Michl, Josef, Marom, Noa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10042130/
https://www.ncbi.nlm.nih.gov/pubmed/36999121
http://dx.doi.org/10.1021/acs.chemmater.2c03444

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