The structure of liquid aluminosilicate under AI2O3 content: simplexes and shell core analyses

Autor:	Mai Van Dung, Tran Thanh Dung, Truong Duc Quynh, Nguyen Manh Tuan, Tran Thanh Nam, Nguyen Van Yen, Hoang Van Hue, Le The Vinh
Rok vydání:	2021
Předmět:	Core (optical fiber) History Materials science Chemical engineering Aluminosilicate Content (measure theory) Shell (structure) Computer Science Applications Education
Zdroj:	Journal of Physics: Conference Series. 2070:012063
ISSN:	1742-6596 1742-6588
Popis:	The structural properties of xAl2O3(1-x)SiO2 liquid systems have been investi-gated by molecular dynamics simulation in a wide range of compositions, x = 0.05–0.7 at 3000 K. The structure of liquid aluminosilicate system is clarified by analyzing the simplex and shell-core. The simulated results showed that the liquid consists of a large quantity of void-simplex, O-simplex, T-simplex, and SC-particle. Our simulation reveals that the densification of the liquid is due to the fact that the number of large simplexes and the radii of simplexes and SC-particles decrease. Besides, results also indicated that the distribution of cations in the liquid is not uniform.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::923afb7dc2ade9d0ea8c9537f7b799ee https://doi.org/10.1088/1742-6596/2070/1/012063 Zobrazit plný text záznamu