Molecular charge distribution, core-ionization energies, and the point-charge approximation

1991 ◽  
Vol 113 (14) ◽  
pp. 5224-5230 ◽  
Author(s):  
Leif J. Saethre ◽  
Michele R. F. Siggel ◽  
T. Darrah Thomas
Keyword(s):  
Charge Distribution ◽  
Point Charge ◽  
Ionization Energies ◽  
Molecular Charge

IR absorption and molecular charge distribution for acrylonitrile

1969 ◽  
Vol 3 (2) ◽  
pp. 91-94 ◽  
Author(s):  
E. M. Popov ◽  
I. P. Yakovlev ◽  
G. A. Kogan
Keyword(s):  
Charge Distribution ◽  
Ir Absorption ◽  
Molecular Charge

Comment on “Surface-charge distribution on a dielectric sphere due to an external point charge: examples of C60 and C240 fullerenes, Phys. Chem. Chem. Phys., 2013, 15, 20115”

2014 ◽  
Vol 16 (28) ◽  
pp. 14969-14970
Author(s):  
Henning Zettergren ◽  
Fredrik Lindén ◽  
Henrik Cederquist
Keyword(s):  
Dielectric Properties ◽  
Surface Charge ◽  
Charge Distribution ◽  
Point Charge ◽  
Chem Phys ◽  
Dielectric Sphere ◽  
External Point ◽  
Surface Charge Distribution ◽  
Phys Chem Chem Phys

We show that the relative surface charge distribution from classical electrostatics cannot be used to discriminate between different assumptions about the dielectric properties of fullerenes interacting with external charges.

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