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An Expedited Route to Optical and Electronic Properties at Finite Temperature via Unsupervised Learning

Electronic properties and absorption spectra are the grounds to investigate molecular electronic states and their interactions with the environment. Modeling and computations are required for the molecular understanding and design strategies of photo-active materials and sensors. However, the interp...

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Detalles Bibliográficos
Autores principales: Perrella, Fulvio, Coppola, Federico, Rega, Nadia, Petrone, Alessio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10144358/
https://www.ncbi.nlm.nih.gov/pubmed/37110644
http://dx.doi.org/10.3390/molecules28083411