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A machine learning platform for the discovery of materials

For photovoltaic materials, properties such as band gap [Formula: see text] are critical indicators of the material’s suitability to perform a desired function. Calculating [Formula: see text] is often performed using Density Functional Theory (DFT) methods, although more accurate calculation are pe...

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Detalles Bibliográficos
Autores principales: Belle, Carl E., Aksakalli, Vural, Russo, Salvy P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8161632/
https://www.ncbi.nlm.nih.gov/pubmed/34044889
http://dx.doi.org/10.1186/s13321-021-00518-y