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Molecular Simulation of Naphthalene, Phenanthrene, and Pyrene Adsorption on MCM-41
The adsorption of three typical polycyclic aromatic hydrocarbons (PAHs), naphthalene, phenanthrene, and pyrene with different ring numbers, on a common mesoporous material (MCM-41) was simulated based on a well-validated model. The adsorption equilibriums (isotherms), states (angle distributions and...
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/PMC6387010/ https://www.ncbi.nlm.nih.gov/pubmed/30717495 http://dx.doi.org/10.3390/ijms20030665 |