nach der Bestellung gedruckt Neuware - Printed after ordering - This book is based on my PhD thesis where I explored the electronic structure calculation of semiconductor quantum dots.All the calculations are based on density functional theory based ab-initio method.The optical properties of Silicon cluster and Quantum Confinement Effect were studied.Also the adsorption of Silicon clusters on metallic (Au/Ag) and insulating(MgO)surface were investigated in order to understand the charge transfer process between adsorbates and surfaces.This can be leading towards catalytic behavior as well studying the gas phase clusters on different surfaces.Also by exploring the nature of optical spectra of Silicon cluster one can understand the optical response of Nano cluster and this may lead to creation of Nano crystalline Silicon Solar Cell.The extensive study of electronic structure optimization of different nano cluster in different size regime had been done by keeping in mind the gloabal minimum structures.For all the calculations VASP,CPMD and PARSEC were used as computing code along with several fortran codes as the post processing program. The readers will be beneficial in terms of getting a profound knowledge in electronic structure calculations.

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Detalles bibliogr�ficos

T�tulo: Electronic Structures of Semiconductor Quantum Dots : A Density Functional Theory Based Journey
Editor: LAP LAMBERT Academic Publishing
Fecha de publicaci�n: 2012
Idioma: Ingl�s
ISBN 10: 3847306006
ISBN 13: 9783847306009
Encuadernaci�n: Taschenbuch
Estado: Neu
Dimensiones: 220�mil�metros de ancho por 150 de alto por 11 de largo
Peso: 280 gramos

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Sinopsis

This book is based on my PhD thesis where I explored the electronic structure calculation of semiconductor quantum dots.All the calculations are based on density functional theory based ab-initio method.The optical properties of Silicon cluster and Quantum Confinement Effect were studied.Also the adsorption of Silicon clusters on metallic (Au/Ag) and insulating(MgO)surface were investigated in order to understand the charge transfer process between adsorbates and surfaces.This can be leading towards catalytic behavior as well studying the gas phase clusters on different surfaces.Also by exploring the nature of optical spectra of Silicon cluster one can understand the optical response of Nano cluster and this may lead to creation of Nano crystalline Silicon Solar Cell.The extensive study of electronic structure optimization of different nano cluster in different size regime had been done by keeping in mind the gloabal minimum structures.For all the calculations VASP,CPMD and PARSEC were used as computing code along with several fortran codes as the post processing program. The readers will be beneficial in terms of getting a profound knowledge in electronic structure calculations.

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