Title of article
Magnetizability and nuclear shielding constants of solvated water
Author/Authors
Mikkelsen، نويسنده , , Kurt V. and Ruud، نويسنده , , Kenneth and Helgaker، نويسنده , , Trygve، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1996
Pages
5
From page
443
To page
447
Abstract
We apply a recently developed model for calculating gauge origin independent molecular magnetic properties of solvated molecules to determine the magnetizability and nuclear shielding constants of solvated water. The solute is surrounded by a solvation shell and this supermolecule is enclosed in a spherical cavity immersed in a dielectric medium.
Journal title
Chemical Physics Letters
Serial Year
1996
Journal title
Chemical Physics Letters
Record number
1776750
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