Computational organic chemistry

Steven M. Bachrach

doi:10.1039/B822063H

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Annual Reports Section "B" (Organic Chemistry)

Issue 0, 2009

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Computational organic chemistry

Steven M. Bachrach

Annu. Rep. Prog. Chem., Sect. B: Org. Chem., 2009, 105, 398-420

DOI: 10.1039/B822063H
First published on the web 22 May 2009

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This review highlights research in computational organic chemistry published in 2008, featuring (i) new reports of the importance of non-statistical dynamics, (ii) continued benchmarking of density functional methods, (iii) exploration of the limits of aromaticity, (iv) tunneling through large barriers in hydroxymethylene and (v) use of computed spectra in structural identification.

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Annual Reports Section "B" (Organic Chemistry)

Computational organic chemistry

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