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Prof. Dr. Marija Baranac-Stojanović, Dr. Andreas Koch and Prof. Dr. Erich Kleinpeter Density Functional Calculations of the Anisotropic Effects of Borazine and 1,3,2,4-Diazadiboretidine ChemPhysChem 13

Article first published online: 25 OCT 2012 | DOI: 10.1002/cphc.201200732

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Isochemical shielding surfaces are used to visualize the anisotropic effects of borazine and planar 1,3,2,4-diazadiboretidine (see picture), which are quantitatively calculated on the basis of the nucleus-independent chemical shift (NICS) concept.

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