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Glass polymorphism in glycerol–water mixtures: I. A computer simulation study

We perform out-of-equilibrium molecular dynamics (MD) simulations of water–glycerol mixtures in the glass state. Specifically, we study the transformations between low-density (LDA) and high-density amorphous (HDA) forms of these mixtures induced by compression/decompression at constant temperature....

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Detalhes bibliográficos
Publicado no:Phys Chem Chem Phys
Main Authors: Jahn, David A., Wong, Jessina, Bachler, Johannes, Loerting, Thomas, Giovambattista, Nicolas
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4847106/
https://ncbi.nlm.nih.gov/pubmed/27063705
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c6cp00075d
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