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Chirality and Relativistic Effects in Os(3)(CO)(12)
The energy and structural parameters were obtained for all forms of the carbonyl complex of osmium Os(3)(CO)(12) with D(3h) and D(3) symmetries using density functional theory (DFT) methods. The calculations took into account various levels of relativistic effects, including those associated with no...
Autores principales: | Ryzhikov, Maxim R., Mirzaeva, Irina V., Kozlova, Svetlana G., Mironov, Yuri V. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8199560/ https://www.ncbi.nlm.nih.gov/pubmed/34206080 http://dx.doi.org/10.3390/molecules26113333 |
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