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Molecular Dynamics Simulation on the Diffusion of Flavor, O(2) and H(2)O Molecules in LDPE Film

The diffusion of five flavor organic molecules, including D-limonene, myrcene, ethyl hexanoate, 2-nonanone, and linalool in low density polyethylene (LDPE) film were investigated by combined experimental and molecular dynamics (MD) simulation studies. The diffusion coefficients derived from the pred...

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Detalles Bibliográficos
Autores principales: Sun, Binqing, Lu, Lixin, Zhu, Yong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6862678/
https://www.ncbi.nlm.nih.gov/pubmed/31717741
http://dx.doi.org/10.3390/ma12213515