Toward realistic computer modeling of paraffin-based composite materials: critical assessment of atomic-scale models of paraffins

Paraffin-based composites represent a promising class of materials with numerous practical applications such as e.g. heat storage. Computer modeling of these complex multicomponent systems requires a proper theoretical description of both the n-alkane matrix and the non-alkane filler molecules. The...

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Detalles Bibliográficos
Autores principales: Glova, Artyom D., Volgin, Igor V., Nazarychev, Victor M., Larin, Sergey V., Lyulin, Sergey V., Gurtovenko, Andrey A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9076000/
https://www.ncbi.nlm.nih.gov/pubmed/35540183
http://dx.doi.org/10.1039/c9ra07325f

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9076000/
https://www.ncbi.nlm.nih.gov/pubmed/35540183
http://dx.doi.org/10.1039/c9ra07325f

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