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Electronic Structure of Disordered Alloys, Surfaces and Interfaces (Paperback, Softcover reprint of the original 1st ed. 1997):... Electronic Structure of Disordered Alloys, Surfaces and Interfaces (Paperback, Softcover reprint of the original 1st ed. 1997)
Ilja Turek, Vaclav Drchal, Josef Kudrnovsky, Mojmir Sob, Peter Weinberger
R6,641 Discovery Miles 66 410 Ships in 10 - 15 working days

At present, there is an increasing interest in the prediction of properties of classical and new materials such as substitutional alloys, their surfaces, and metallic or semiconductor multilayers. A detailed understanding based on a thus of the utmost importance for fu microscopic, parameter-free approach is ture developments in solid state physics and materials science. The interrela tion between electronic and structural properties at surfaces plays a key role for a microscopic understanding of phenomena as diverse as catalysis, corrosion, chemisorption and crystal growth. Remarkable progress has been made in the past 10-15 years in the understand ing of behavior of ideal crystals and their surfaces by relating their properties to the underlying electronic structure as determined from the first principles. Similar studies of complex systems like imperfect surfaces, interfaces, and mul tilayered structures seem to be accessible by now. Conventional band-structure methods, however, are of limited use because they require an excessive number of atoms per elementary cell, and are not able to account fully for e.g. substitu tional disorder and the true semiinfinite geometry of surfaces. Such problems can be solved more appropriately by Green function techniques and multiple scattering formalism.

Electronic Structure of Disordered Alloys, Surfaces and Interfaces (Hardcover, 1997 ed.): Ilja Turek, Vaclav Drchal, Josef... Electronic Structure of Disordered Alloys, Surfaces and Interfaces (Hardcover, 1997 ed.)
Ilja Turek, Vaclav Drchal, Josef Kudrnovsky, Mojmir Sob, Peter Weinberger
R6,835 Discovery Miles 68 350 Ships in 10 - 15 working days

At present, there is an increasing interest in the prediction of properties of classical and new materials such as substitutional alloys, their surfaces, and metallic or semiconductor multilayers. A detailed understanding based on a thus of the utmost importance for fu microscopic, parameter-free approach is ture developments in solid state physics and materials science. The interrela tion between electronic and structural properties at surfaces plays a key role for a microscopic understanding of phenomena as diverse as catalysis, corrosion, chemisorption and crystal growth. Remarkable progress has been made in the past 10-15 years in the understand ing of behavior of ideal crystals and their surfaces by relating their properties to the underlying electronic structure as determined from the first principles. Similar studies of complex systems like imperfect surfaces, interfaces, and mul tilayered structures seem to be accessible by now. Conventional band-structure methods, however, are of limited use because they require an excessive number of atoms per elementary cell, and are not able to account fully for e.g. substitu tional disorder and the true semiinfinite geometry of surfaces. Such problems can be solved more appropriately by Green function techniques and multiple scattering formalism."

Computational Quantum Physics and Chemistry of Nanomaterials (Hardcover): Mojmir Sob Computational Quantum Physics and Chemistry of Nanomaterials (Hardcover)
Mojmir Sob
R1,440 R1,214 Discovery Miles 12 140 Save R226 (16%) Ships in 10 - 15 working days
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