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Article
Role of dipole image forces in molecular adsorption
Electrostatic image force energy W was calculated for a finite-size (extended) dipole located in vacuum near a plane surface of a condensed-matter substrate using the HF molecule over graphite as an example. The ...
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Article
Gravimetric And Quantum-chemical Study of Interaction of Monoethanolamine Vapor With Silica Surface
Kinetics of the monoethanolamine vapor adsorption on the surface of silica previously deposited onto quartz plate was examined by the piezoelectric microweighing. With the assumptions which are in accord with ...
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Article
Comparative investigation of the electronic structure and acidic properties of aluminophophates and of silicoaluminophosphates
The spatial and electronic structures of alumino- and silicoaluminophosphates have been investigated by quantum chemical SCF MO LCAO MNDO method. The implantation of silicon atoms into aluminophosphate matrix ...
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Chapter and Conference Paper
On the charge distribution and the lattice distortion of quasi-one-dimensional systems
Electrostatic energy and electronic structure of donor-acceptor molecular crystals based on tetracyanquinodimethane is considered. The ground state energy of quasi-one-dimensional systems consisting of electro...