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Dispersion Interactions between Molecules in and out of Equilibrium Geometry: Visualization and Analysis
[Image: see text] The London dispersion interactions between systems undergoing bond breaking, twisting, or compression are not well studied due to the scarcity and the high computational cost of methods being able to describe both the dynamic correlation and the multireference character of the syst...
Autores principales: | Kowalski, Piotr H., Krzemińska, Agnieszka, Pernal, Katarzyna, Pastorczak, Ewa |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8883464/ https://www.ncbi.nlm.nih.gov/pubmed/35166552 http://dx.doi.org/10.1021/acs.jpca.2c00004 |
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