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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...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2019
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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 |