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Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters
[Image: see text] The nucleation process leading to the formation of new atmospheric particles plays a crucial role in aerosol research. Quantum chemical (QC) calculations can be used to model the early stages of aerosol formation, where atmospheric vapor molecules interact and form stable molecular...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2023
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10688134/ https://www.ncbi.nlm.nih.gov/pubmed/38046341 http://dx.doi.org/10.1021/acsomega.3c06794 |