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First-Principles Calculations in Real-Space Formalism: Electronic Configurations and Transport Properties of Nanostructures

Обложка книги First-Principles Calculations in Real-Space Formalism: Electronic Configurations and Transport Properties of Nanostructures

First-Principles Calculations in Real-Space Formalism: Electronic Configurations and Transport Properties of Nanostructures

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This timely volume addresses novel methods for calculating electronic transport properties using real-space formalisms free from geometrical restrictions. The book comprises two parts: The first details the basic formalism of the real-space finite-difference method and its applications. This provides the theoretical foundation for the second part of the book, which presents the methods for calculating the properties of electronic transport through nanostructures sandwiched by semi-infinite electrodes.
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