Electronic structure of disordered binary alloys with short range correlation in Bethe lattice
Description
The determination of the electronic structure of a disordered material along the tight-binding model when applied to a Bethe lattice. The diagonal as well as off-diagonal disorder, are considered. The coordination number on the Bethe is fixed lattice to four (Z=4) that occurs in most compound semiconductors. The main proposal was to study the conditions under which a relatively simple model of a disordered material, i.e, a binary alloy, could account for the basic properties of transport or more specifically for the electronic states in such systems. By using a parametrization of the pair probability the behaviour of the electronic density of states (DOS) for different values of the short range order parameter, σ, which makes possible to treat the segregated, random and alternating cases, was analysed. In solving the problem via the Green function technique in the Wannier representation a linear chain of atoms was considered and using the solution of such a 1-D system the problem of the Bethe lattice which is constructed using such renormalized chains as elements, was solved. The results indicate that the obtained DOS are strongly dependent on the correlation assumed for the occupancy in the lattice. (author)
Availability note (English)
MF available from INIS under the Report Number.Abstract (Portuguese)
Apresenta-se a determinacao da estrutura eletronica de um material desordenado usando o modelo tight-binding aplicado a uma rede de Bethe. Consideram-se tanto desordem diagonal quanto nao diagonal, mas fixa-se o numero de coordenacao da rede de Bethe em Z=4 porque esta e uma caracteristica da maioria dos compostos semicondutores. O principal objetico foi determinar sob que condicoes, um modelo relativamente simples de um material desordenado, i.e., uma liga binaria, poderia dar conta das propriedades basicas de transporte ou, mais especificamente, dos estados eletronicos em tais sistemas. Usando uma parametrizacao das propriedades de pares analisou-se comportamento da densidade de estados eletronicos (DOS) para diferentes valores do parametro de curto alcance (SRO), σ, que torna possivel o tratamento dos casos segregado, aleatorio e alternado. Resolvendo o problema por meio da tecnica, das funcoes de Green (FG) na representacao de Wannier, considerou-se uma cadeia linear de atomos e, utilizando a solucao de um tal sistema, resolveu-se o problema da rede de Bethe construida a partir de cadeias lineares renormalizadas. Os resultados indicam que as DOS obtidas sao fortemente dependentes da correlacao de ocupacao dos sitios da rede. (autor)Files
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Additional details
Additional titles
- Original title (Portuguese)
- Estrutura eletronica de ligas binarias desordenadas com correlacao de curto alcance em uma rede de Bethe
Publishing Information
- Imprint Pagination
- 89 p.
- Report number
- INIS-BR--1953
INIS
- Country of Publication
- Brazil
- Country of Input or Organization
- Brazil
- INIS RN
- 21041078
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Resource subtype / Literary indicator
- Thesis
- Descriptors DEI
- BINARY ALLOY SYSTEMS; COORDINATION NUMBER; CORRELATIONS; CRYSTAL LATTICES; ELECTRONIC STRUCTURE; GREEN FUNCTION; INTERACTION RANGE; ORDER PARAMETERS
- Descriptors DEC
- ALLOY SYSTEMS; CRYSTAL STRUCTURE; DISTANCE; FUNCTIONS