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Structure-dependent optoelectronic properties of perylene, di-indenoperylene (DIP) isolated molecule and DIP molecular crystal

Theoretical simulations were designed by first principles approach of density functional theory to investigate the structural and optoelectronic properties of different structural classes of perylene; isolated perylene, diindeno[1,2,3-cd:1′,2′,3′-lm]perylene (DIP) molecule and DIP molecular crystal....

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Detalles Bibliográficos
Autores principales: Mohamad, Mazmira, Ahmed, Rashid, Shaari, Amirudin, Goumri-Said, Souraya
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5712299/
https://www.ncbi.nlm.nih.gov/pubmed/29198000
http://dx.doi.org/10.1186/s13065-017-0352-7