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Current-induced density, anisotropy

The ACID method (anisotropy of the current-induced density) provides a method to visualize, as an isosurface, delocalization of electrons in molecules.One major advantage of this method is its invariance with respect to the relative orientation between molecule and magnetic... [Pg.61]

Herges ACID (anisotropy of the current induced density) M... [Pg.48]

This is another effective approach to estimate the magnetic aspect aromaticity. The current density indicates ring currents in aromatic systems and is more closer to the general definition of delocalization. The anisotropy of the current (induced) density (ACID) is analogous to the anisotropy of the magnetic susceptibility [101]. The induced current density J is given by... [Pg.45]

Another magnetic indicator of aromaticity proposed by Herges et al. [60] is based on the anisotropy of the induced current density (ACID), which can also be... [Pg.222]

Geuenich, D., Hess, K., Kohler, F., and Herges, R. 2005. Anisotropy of the Induced Current Density (ACID), a general method to quantify and visualize electronic delocalization. Chem. Rev. 105 3758-3772. [Pg.53]

See other pages where Current-induced density, anisotropy is mentioned: [Pg.59]    [Pg.396]    [Pg.3]    [Pg.345]    [Pg.78]    [Pg.30]    [Pg.301]    [Pg.2805]    [Pg.150]    [Pg.104]    [Pg.58]    [Pg.2805]    [Pg.231]    [Pg.489]    [Pg.13]    [Pg.311]    [Pg.172]    [Pg.100]    [Pg.45]    [Pg.317]    [Pg.410]    [Pg.541]    [Pg.62]   
See also in sourсe #XX -- [ Pg.59 ]



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Anisotropy of the current-induced density

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