Evaluation of the concentration of boroxol rings in vitreous B2O3 by the stochastic matrix method

被引:32
作者
Barrio, RA [1 ]
Kerner, R [1 ]
Micoulaut, M [1 ]
Naumis, GG [1 ]
机构
[1] UNIV PARIS 06,LAB GCR,F-75005 PARIS,FRANCE
关键词
D O I
10.1088/0953-8984/9/43/008
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
A statistical model in which the stochastic matrix method is applied is used to find the fraction of boron atoms belonging to boroxol rings in a boron oxide (B2O3) glass. The method also enables one to evaluate the characteristic energies related to the formation of a single B-O-B unit in an oxygen bridge or in a boroxol ring. The qualitative behaviour of the heat capacity C-p(T) during the glass transition is reproduced, with the inflexion point at the temperature given by the experiment. The model also gives a reasonable qualitative prediction for a characteristic exponent ruling the growth of microclusters, which may in turn be related to the specific volume.
引用
收藏
页码:9219 / 9234
页数:16
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