The ionic properties of CaSiO3 melt

Authors
Huang, S Jiang, G You, J Yoshida, E Xu, K
Citation
S. Huang et al., The ionic properties of CaSiO3 melt, MET MAT T B, 31(6), 2000, pp. 1241-1245
Citations number
18
Categorie Soggetti
Metallurgy
Journal title
METALLURGICAL AND MATERIALS TRANSACTIONS B-PROCESS METALLURGY AND MATERIALS PROCESSING SCIENCE
ISSN journal
10735615 → ACNP
Volume
31
Issue
6
Year of publication
2000
Pages
1241 - 1245
Database
ISI
SICI code
1073-5615(200012)31:6<1241:TIPOCM>2.0.ZU;2-J
Abstract
Molecular dynamics simulation of CaSiO3 melt was carried out using the effe ctive pair potential model, with reasonable values of the interaction param eter. The result of the partial radial distribution function, the self-diff usion coefficient, and the electrical conductivity reasonably agrees with e xperiments. The density of states is calculated to compare with Raman spect ra. Our results showing a strong vibration band in the range of 800 to 1000 cm(-1) are consistent with experiments.