Title of article
Modelling of oxide surfaces
Author/Authors
Gillan، نويسنده , , Michael J and Kantorovich، نويسنده , , Lev N and Lindan، نويسنده , , Philip J.D.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1996
Pages
7
From page
820
To page
826
Abstract
Ab initio methods have led to very rapid recent progress in the modelling of oxide surfaces. They have made important contributions to knowledge of three areas: equilibrium surface structure; the energetics and structures associated with oxidation and reduction; and the energetics of adsorption and dissociation of simple molecules such as H2O and HCOOH.
Journal title
Current Opinion in Solid State and Materials Science
Serial Year
1996
Journal title
Current Opinion in Solid State and Materials Science
Record number
2087812
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