Published August 22, 2007 | Version v1
Journal article

Network structure of 0.7SiO2-0.3Na2O glass from neutron and x-ray diffraction and RMC modelling

  • 1. Research Institute for Solid State Physics and Optics, H-1525 Budapest, POB 49 (Hungary)
  • 2. Los Alamos National Laboratory, Lujan Neutron Scattering Ctr, Los Alamos, NM 87545 (United States)
  • 3. Babes-Bolyai University, Faculty of Chemistry, 11 Arany Janos Street, RO-3400 Cluj (Romania)

Description

The structure of 0.7SiO2-0.3Na2O glass was investigated by means of neutron and high-energy x-ray diffraction. The maximum momentum transfer was 35 and 23.5 A-1 for the two experiments. The two datasets were modelled simultaneously by the reverse Monte Carlo simulation technique. By using reasonable constraints it was possible to separate the six partial pair correlation functions. Nearest neighbour distances, coordination numbers and bond angle distributions have been revealed. It was found that 63% of the O atoms are in the bridging position. The Na-O distance is 2.29 A and the coordination number is 2.5. The Na-Na nearest neighbour distance is 2.6 A, a value significantly smaller than previously reported. Neighbouring sodium ions tend to be located at the same oxygen atom. The average Si-O ring size is 7.6

Additional details

Identifiers

DOI
10.1088/0953-8984/19/33/335209;
PII
S0953-8984(07)43904-2;

Publishing Information

Journal Title
Journal of Physics. Condensed Matter
Journal Volume
19
Journal Issue
33
Journal Page Range
p. 335209
ISSN
0953-8984
CODEN
JCOMEL

Conference

Title
The first eighteen years of reverse Monte Carlo modelling
Acronym
3. workshop on reverse Monte Carlo (RMC)
Dates
28-30 Sep 2006
Place
Budapest (Hungary)