COMPUTER-SIMULATION OF THE STRUCTURE AND PROPERTIES OF NONCRYSTALLINEOXIDES

Authors
Citation
Dk. Belashchenko, COMPUTER-SIMULATION OF THE STRUCTURE AND PROPERTIES OF NONCRYSTALLINEOXIDES, Uspehi himii, 66(9), 1997, pp. 811-844
Citations number
222
Categorie Soggetti
Chemistry
Journal title
ISSN journal
00421308
Volume
66
Issue
9
Year of publication
1997
Pages
811 - 844
Database
ISI
SICI code
0042-1308(1997)66:9<811:COTSAP>2.0.ZU;2-Q
Abstract
The structure data and some properties of non-crystalline (liquid and amorphous) oxide systems are discussed that were obtained using comput er simulation methods. The simple oxide models, the homological serii of simple oxides, the models of binary and multi-components oxide syst ems are considered. Also the results of the simulation of ionic transf er in electric field are discussed. Ionic theory of oxides allows to p redict the structure, thermodynamic and other properties for many oxid e systems except the phosphate and vanadate oxides and some others.