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Expanding the usage of the Source Function to experimental electron densities
Author(s) -
Overgaard Jacob
Publication year - 2016
Publication title -
acta crystallographica section b
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.604
H-Index - 33
ISSN - 2052-5206
DOI - 10.1107/s2052520616004674
Subject(s) - delocalized electron , electron delocalization , function (biology) , electron , chemical physics , information source (mathematics) , computer science , atomic physics , statistical physics , physics , materials science , chemistry , nanotechnology , quantum mechanics , mathematics , statistics , evolutionary biology , biology
The Source Function provides unique information about chemical bonding in the solid state, from theory as well as from experiment. It is now established that the concept of electronic delocalization in aromatic systems can be accurately studied using X‐ray derived electron densities, and even more importantly the contributions are transferable between similar systems.