Self-consistent theory of the surface thermodynamic properties of strongly anharmonic crystals

1984 ◽  
Vol 27 (3) ◽  
pp. 235-239
Author(s):  
V. I. Zubov
Keyword(s):  
Thermodynamic Properties ◽  
Consistent Theory ◽  
Self Consistent ◽  
Anharmonic Crystals

THE MICROSCOPIC THEORY OF THE SURFACE PROPERTIES OF ANHARMONIC CRYSTALS I: General Method and (001) Surface of BCC Crystal

1992 ◽  
Vol 06 (02) ◽  
pp. 197-219 ◽  
Author(s):  
V. I. ZUBOV ◽  
I. V. MAMONTOV ◽  
N. P. TRETYAKOV
Keyword(s):  
Surface Properties ◽  
Helmholtz Free Energy ◽  
Three Dimensional ◽  
Microscopic Theory ◽  
Lattice Relaxation ◽  
Surface Anisotropy ◽  
Consistent Theory ◽  
Self Consistent ◽  
Anharmonic Crystals ◽  
General Method

The self-consistent theory of the structural, dynamical, and thermodynamic surface properties of anharmonic crystals previously given for one- and two-dimensional models is extended to the surfaces of three-dimensional crystals which take into account the surface anisotropy. After considering the reference system, in the general case, the equations for the properties of the interface cyrstal-vapour to the second order in the temperature are derived. The (001) face of the BCC crystal is investigated. The lattice relaxation and dynamics are calculated. The surface Helmholtz free energy and other thermodynamic properties are obtained. At high temperatures, the surface specific heat increases linearly with temperature due to the anharmonicity.

Self-Consistent Theory of Delocalization

1990 ◽  
Vol 160 (2) ◽  
pp. 569-581 ◽  
Author(s):  
A. I. Olemskoi
Keyword(s):  
Consistent Theory ◽  
Self Consistent

A novel self-consistent theory of the electronic structure of inversion layers in InSb MIS structures

1986 ◽  
Vol 134 (2) ◽  
pp. 837-845 ◽  
Author(s):  
J.-P. Zöllner ◽  
H. Übensee ◽  
G. Paasch ◽  
T. Fiedler ◽  
G. Gobsch
Keyword(s):  
Electronic Structure ◽  
Consistent Theory ◽  
Self Consistent ◽  
Mis Structures
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