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Origin-Independent Dynamic Polarizability Density from Coupled Cluster Response Theory
[Image: see text] The calculation of the origin-independent density of the dynamic electric dipole polarizability, previously presented for uncorrelated and density functional theory (DFT)-based methods, has been developed and implemented at the coupled cluster singles and doubles (CCSD) level of th...
Autores principales: | Summa, F. F., Andersen, J. H., Lazzeretti, P., Sauer, S. P. A., Monaco, G., Coriani, S., Zanasi, R. |
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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/PMC10601476/ https://www.ncbi.nlm.nih.gov/pubmed/37796868 http://dx.doi.org/10.1021/acs.jctc.3c00753 |
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