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Molecular dynamics simulations of liquid silica crystallization

Silica is one of the most abundant minerals on Earth and is widely used in many fields. Investigating the crystallization of liquid silica by atomic simulations is of great importance to understand the crystallization mechanism; however, the high crystallization barrier and the tendency of silica to...

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Detalhes bibliográficos
Publicado no:Proc Natl Acad Sci U S A
Main Authors: Niu, Haiyang, Piaggi, Pablo M., Invernizzi, Michele, Parrinello, Michele
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6003482/
https://ncbi.nlm.nih.gov/pubmed/29735667
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1803919115
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