Title of article
Structure of the metal-liquid interface: self-consistent combination of the first-principles metal calculation and an integral equation method
Author/Authors
Yamamoto، نويسنده , , Masahiro and Kinoshita، نويسنده , , Masahiro، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1997
Pages
5
From page
513
To page
517
Abstract
This letter contributes to development of microscopic theories for the metal/liquid interface. We report results of the first attempt to combine the first-principles calculation for the metal surface and the reference hypernetted-chain method for the liquid in a fully self-consistent manner. The dipolar liquid/Pt(111) interface is considered. The electron density, liquid structure, and electrostatic potential across the interface are briefly discussed.
Journal title
Chemical Physics Letters
Serial Year
1997
Journal title
Chemical Physics Letters
Record number
1781714
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