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Nanoscale π–π stacked molecules are bound by collective charge fluctuations
Non-covalent π−π interactions are central to chemical and biological processes, yet the full understanding of their origin that would unite the simplicity of empirical approaches with the accuracy of quantum calculations is still missing. Here we employ a quantum-mechanical Hamiltonian model for van...
Autores principales: | Hermann, Jan, Alfè, Dario, Tkatchenko, Alexandre |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5309697/ https://www.ncbi.nlm.nih.gov/pubmed/28169280 http://dx.doi.org/10.1038/ncomms14052 |
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