Heterogeneous Nucleation of Butanol on NaCl: A Computational Study of Temperature, Humidity, Seed Charge, and Seed Size Effects

[Image: see text] Using a combination of quantum chemistry and cluster size distribution dynamics, we study the heterogeneous nucleation of n-butanol and water onto sodium chloride (NaCl)(10) seeds at different butanol saturation ratios and relative humidities. We also investigate how the heterogene...

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Detalles Bibliográficos
Autores principales: Toropainen, Antti, Kangasluoma, Juha, Kurtén, Theo, Vehkamäki, Hanna, Keshavarz, Fatemeh, Kubečka, Jakub
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8054243/
https://www.ncbi.nlm.nih.gov/pubmed/33788572
http://dx.doi.org/10.1021/acs.jpca.0c10972

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8054243/
https://www.ncbi.nlm.nih.gov/pubmed/33788572
http://dx.doi.org/10.1021/acs.jpca.0c10972

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