The authors present a simplified tight-binding-based coherent-potential approximation (CPA) formalism for the host electronic structure of semiconductor alloys (e.g. Ga1-xAlxAs). Several schemes to locate the gap level due to point defects are discussed. In particular, they introduce a novel scheme: the deep-level approximation. They also point out that the vacancy results in the CPA are identical with the simpler virtual-crystal approximation. They discuss their results by presenting numerical results in Ga1-xAlxAs and GaAs1-xSbx
In this thesis, we investigate the electronic and optical properties of pure as well as of substitu...
The present work reviews the progress in the determination and understanding of the atomic structure...
We present a method for the efficient calculation of the electronic structure of semiconductors with...
A simplified tight-binding approach based on the coherent potential approximation (CPA) formalism is...
A simplified tight-binding approach based on the coherent potential approximation (CPA) formalism is...
Using electronic structure calculations, we systematically investigate the formation of vacancies in...
We present a quantitative parameter-free method for calculating defect states and charge-transition ...
We present a quantitative parameter-free method for calculating defect states and charge-transition ...
The electronic density of states (DOS), charge densities, equilibrium bond lengths, and optical bowi...
The electronic density of states (DOS), charge densities, equilibrium bond lengths, and optical bowi...
This text surveys the theory of defects in solids, concentrating on the electronic structure of poin...
The native defects in the compound semiconductor GaP have been studied using a pseudopotential densi...
Molecular dynamics with analytical potentials is commonly used to obtain the distribution of defects...
In part I, we have calculated the structural properties of Si using an iterative method and the pre...
Theoretical studies of point defect interactions and structural stability of compounds have been per...
In this thesis, we investigate the electronic and optical properties of pure as well as of substitu...
The present work reviews the progress in the determination and understanding of the atomic structure...
We present a method for the efficient calculation of the electronic structure of semiconductors with...
A simplified tight-binding approach based on the coherent potential approximation (CPA) formalism is...
A simplified tight-binding approach based on the coherent potential approximation (CPA) formalism is...
Using electronic structure calculations, we systematically investigate the formation of vacancies in...
We present a quantitative parameter-free method for calculating defect states and charge-transition ...
We present a quantitative parameter-free method for calculating defect states and charge-transition ...
The electronic density of states (DOS), charge densities, equilibrium bond lengths, and optical bowi...
The electronic density of states (DOS), charge densities, equilibrium bond lengths, and optical bowi...
This text surveys the theory of defects in solids, concentrating on the electronic structure of poin...
The native defects in the compound semiconductor GaP have been studied using a pseudopotential densi...
Molecular dynamics with analytical potentials is commonly used to obtain the distribution of defects...
In part I, we have calculated the structural properties of Si using an iterative method and the pre...
Theoretical studies of point defect interactions and structural stability of compounds have been per...
In this thesis, we investigate the electronic and optical properties of pure as well as of substitu...
The present work reviews the progress in the determination and understanding of the atomic structure...
We present a method for the efficient calculation of the electronic structure of semiconductors with...