SHORT-RANGE AND MEDIUM-RANGE ORDER IN LITHIUM SILICATE CLASSES .2. SIMULATION OF THE STRUCTURE BY THE REVERSE MONTE-CARLO METHOD

Citation
H. Uhlig et al., SHORT-RANGE AND MEDIUM-RANGE ORDER IN LITHIUM SILICATE CLASSES .2. SIMULATION OF THE STRUCTURE BY THE REVERSE MONTE-CARLO METHOD, Journal of the American Ceramic Society, 79(11), 1996, pp. 2839-2846
Citations number
16
Categorie Soggetti
Material Science, Ceramics
ISSN journal
00027820
Volume
79
Issue
11
Year of publication
1996
Pages
2839 - 2846
Database
ISI
SICI code
0002-7820(1996)79:11<2839:SAMOIL>2.0.ZU;2-1
Abstract
The results of X-ray and neutron diffraction experiments with (Li2O)(x )(SiO2)(100-x) glasses (x = 0, 20, 33.3, and 40) are discussed using t he Reverse Monte Carlo method to produce atomic clusters, which are an alyzed with respect to the O-O distribution, the angular correlations within the first and higher coordination spheres, and the bond-orienta tional multipole moments, Within Li2O-containing silicate glasses, eac h lithium atom is surrounded by a ring of six SiO4 tetrahedra in such a way that four oxygen atoms lie at the joints of a tetragonal cell en tered by lithium. Thus, the lithium atoms increase the order of the gl ass.