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Toward Understanding the Isomeric Stability of Fullerenes with Density Functional Theory and the Information-Theoretic Approach
[Image: see text] For a given size of one fullerene molecule, there could exist many different isomers and their energy landscape is remarkably complex. To have a better understanding of the nature and origin of their isomeric stability, as a continuation of our previous endeavors, we systematically...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2018
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6643390/ https://www.ncbi.nlm.nih.gov/pubmed/31458389 http://dx.doi.org/10.1021/acsomega.8b02702 |