img Leseprobe Leseprobe

Theoretical Modeling of Inorganic Nanostructures

Symmetry and ab initio Calculations of Nanolayers, Nanotubes and Nanowires

R. A. Evarestov

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ca. 181,89
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Springer International Publishing img Link Publisher

Naturwissenschaften, Medizin, Informatik, Technik / Atomphysik, Kernphysik

Beschreibung

This book summarizes the state of the art in the theoretical modeling of inorganic nanostructures. Extending the first edition, published in 2015, it presents applications to new nanostructured materials and theoretical explanations of  recently discovered  optical  and thermodynamic properties of known nanomaterials. It discusses the developments in theoretical modeling of nanostructures, describing fundamental approaches such as symmetry analysis and applied calculation methods. The book also examines the theoretical aspects of many thermodynamic and the optical properties of nanostructures. The new edition includes additional descriptions of the theoretical modeling of nanostructures in novel materials such as the V2O5 binary oxide, ZnS, CdS, MoSSe and SnS2.

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Schlagwörter

symmetry of monoperiodic systems, theoretical, mathematical and computational physics, theoretical and computational chemistry, classification of 1D inorganic nanostructures, elctronic properties of 1D inorganic nanostructures, simulation and modeling of nanostructures, LCAO methods of calculations, dynamic properties of 1D inorganic nanostructures