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Coupled-Cluster Density-Based Many-Body Expansion
[Image: see text] While CCSD(T) is often considered the “gold standard” of computational chemistry, the scaling of its computational cost as N(7) limits its applicability for large and complex molecular systems. In this work, we apply the density-based many-body expansion [Int. J. Quantum Chem.2020,...
| 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/PMC10626589/ https://www.ncbi.nlm.nih.gov/pubmed/37871170 http://dx.doi.org/10.1021/acs.jpca.3c04591 |