Title of article :
The double role played by the Gd2O3 in the gadolinium–aluminum–borate–bismuthate quaternary glass forming tendency. GdBO3 crystalline phase
Author/Authors :
Rada، نويسنده , , S. and Culea، نويسنده , , M. and Rada، نويسنده , , M. and Pascuta، نويسنده , , P. and Maties، نويسنده , , V. and Culea، نويسنده , , E.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2009
Abstract :
Glasses and glass–ceramics in the xGd2O3·(100 − x)[2Bi2O3·B2O3·Al2O3] system with x = 0, 1, 5, 10, 15, 20, 25, 30, 35, 50 mol% Gd2O3 have been prepared by the melt quenching method. The changes of the IR spectral features suggest that the formation of [BO4] tetrahedra is reduced because the modified [BO3] units containing one or more B–O–Gd bonds are unable to accept the fourth oxygen.
on our results, we conclude that the accommodation of the networks with the excess of oxygen is possible by the deformation of Bi–O–Bi linkages, the participation of aluminum atoms as network formers and the intercalation of [BiO6] and [AlO4] entities in the [BO4] chain network.
igh Gd2O3 content is introduced, more [BO3] structural units are coupled with gadolinium ions and the accumulation of oxygen can be supported by the formation of new [BO3]−3 structural units as ortho-borate units. These yield the formation of GdBO3 crystalline phase which has been confirmed by XRD investigations.
ing the theoretical and experimental IR spectral characteristic features, we conclude that the prediction of the structural data is good.
Keywords :
Gadolinium–alumino-borate–bismuthate glasses , DFT calculations , FTIR SPECTROSCOPY
Journal title :
Journal of Molecular Structure
Journal title :
Journal of Molecular Structure