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Strategies for the Development of Conjugated Polymer Molecular Dynamics Force Fields Validated with Neutron and X-ray Scattering

[Image: see text] Conjugated polymers (CPs) enable a wide range of lightweight, lower cost, and flexible organic electronic devices, but a thorough understanding of relationships between molecular structure and dynamics and electronic performance is critical for improved device efficiencies and for...

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Detalles Bibliográficos
Autores principales: Wolf, Caitlyn M., Guio, Lorenzo, Scheiwiller, Sage, Pakhnyuk, Viktoria, Luscombe, Christine, Pozzo, Lilo D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9954299/
https://www.ncbi.nlm.nih.gov/pubmed/36855657
http://dx.doi.org/10.1021/acspolymersau.1c00027