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Atomistic simulation study of linear alkylbenzene sulfonates at the water/air interface
Molecular Dynamics simulations with the CHARMM atomistic force field have been used to study monolayers of a series of linear alkylbenzene sulfonates (LAS) at the water/air interface. Both the numbers of carbon atoms in the LAS alkyl tail (1 to 11), and the position of attachment of the benzene ring...
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| Main Authors: | , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2010
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2924668/ https://ncbi.nlm.nih.gov/pubmed/20614916 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp101860v |
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