Propriedades ferroelétricas, microestruturais e ópticas dos materiais cerâmicos Ba0,5 Sr0,5 (Ti1-ySny) O3
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Data
2006-03-22
Autores
Souza, Iêdo Alves de [UNESP]
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Universidade Estadual Paulista (Unesp)
Resumo
Materiais cerâmicos à base de titanato de estrôncio e bário puro (BST) e dopado com estanho (BST:Sn), apresentam propriedades ferroelétricas e ópticas com importantes aplicações tecnológicas. Essas propriedades dependem da estequiometria do material, rota de síntese e processamento e dopagem. No presente trabalho foi desenvolvido o estudo das propriedades ferroelétricas, microestruturais e ópticas do sistema Ba0,5Sr0,5(Ti1-ySny)O3, em variadas porcentagens molares (mol %), para pós e filmes sintetizados pelo método dos precursores poliméricos (MPP). Neste método foram utilizados, como principais fontes de cátions, carbonato de bário, carbonato de estrôncio e isopropóxido de titânio. Como agente complexante foi utilizado o ácido cítrico e como agente polimerizante o etilenoglicol. Os resultados experimentais e os cálculos mecânico-quânticos, realizados utilizando-se métodos de cálculos ab inítio com o programa CRISTAL98, indicaram que a PL pode estar associada com defeitos presentes na estrutura desordenada do BST e BST:Sn. As medidas de absorbância associadas com a caracterização fotoluminescente sugerem um band gap não uniforme com níveis de energia localizados dentro da região do gap, os quais atuam como centro de absorção óptica e isto é a principal razão pela PL visível em temperatura ambiente.
Ceramic materials based on strontium and barium titanate (BST) pure or doped with Sn (BST:Sn), posses ferroelectric and optical properties which important technological applications. Those properties are affected by sthoichiometry of material, synthesis and processing route and dopants. In our case the ferroelectric and optical properties and microstructure of system Ba0,5Sr0,5(Ti1-xSnx)O3 were investigated, considering various molar percentages (mol %) for powders and films synthesized by polymeric precursor method (MPP). In this method it was utilized, as a main source of cations, barium carbonate, strontium carbonate and titanium isopropoxide. For reaction of complexation was used cytric acid and for polymerization was used ethylene glycol. The experimental results and quantum-mechanical calculations using ab initio calculation method with program CRISTAL98, pointed to that PL could be associated with defects present in disordered structure of BST and BST:Sn. The measurement of absorbance associated with the photoluminescence characterization suggests that band gap is not uniform due to energy levels localized inside the gap region, which act as a center of optical absorption and it is the main reason for PL visible at room temperature.
Ceramic materials based on strontium and barium titanate (BST) pure or doped with Sn (BST:Sn), posses ferroelectric and optical properties which important technological applications. Those properties are affected by sthoichiometry of material, synthesis and processing route and dopants. In our case the ferroelectric and optical properties and microstructure of system Ba0,5Sr0,5(Ti1-xSnx)O3 were investigated, considering various molar percentages (mol %) for powders and films synthesized by polymeric precursor method (MPP). In this method it was utilized, as a main source of cations, barium carbonate, strontium carbonate and titanium isopropoxide. For reaction of complexation was used cytric acid and for polymerization was used ethylene glycol. The experimental results and quantum-mechanical calculations using ab initio calculation method with program CRISTAL98, pointed to that PL could be associated with defects present in disordered structure of BST and BST:Sn. The measurement of absorbance associated with the photoluminescence characterization suggests that band gap is not uniform due to energy levels localized inside the gap region, which act as a center of optical absorption and it is the main reason for PL visible at room temperature.
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Fotoluminescencia, Ferroeletricidade, Físico-química, Photoluminescence, Ferroelectric
Como citar
SOUZA, Iêdo Alves de. Propriedades ferroelétricas, microestruturais e ópticas dos materiais cerâmicos Ba0,5 Sr0,5 (Ti1-ySny) O3. 2006. 106 f. Tese (doutorado) - Universidade Estadual Paulista, Instituto de Química, 2006.