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Rapid adsorption enthalpy surface sampling (RAESS) to characterize nanoporous materials
Molecular adsorption in nanoporous materials has many large-scale industrial applications ranging from separation to storage. To design the best materials, computational simulations are key to guiding the experimentation and engineering processes. Because nanoporous materials exist in a plethora of...
Autores principales: | Ren, Emmanuel, Coudert, François-Xavier |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9931060/ https://www.ncbi.nlm.nih.gov/pubmed/36819873 http://dx.doi.org/10.1039/d2sc05810c |
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