Aromatic pathways in carbathiaporphyrins

Magnetically induced current densities and current pathways have been calculated for carbaporphyrins and carbathiaporphyrins using the gauge including magnetically induced current (GIMIC) method. The aromatic character and current pathways are obtained from the calculated current density susceptibil...

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Bibliographic Details
Published in:The Journal of Physical Chemistry A Vol. 119, № 7. P. 1201-1207
Main Author: Valiev, Rashid R.
Other Authors: Fliegl, Heike, Sundholm, Dage
Format: Article
Language:English
Subjects:
Online Access:http://vital.lib.tsu.ru/vital/access/manager/Repository/vtls:000569901
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