Investigation of Pressure Effect on Structure of 3Al2O3.2SiO2 System

• المؤلفون الرئيسيون: Pham, Tri Dung, Nguyen, Quang Bau, Nguyen, Thi Thu Ha, Mai, Thi Lan
• التنسيق: مقال
• اللغة: English
• منشور في: H. : ĐHQGHN 2020
• الموضوعات: Molecular dynamics simulation; Mullite; Structure; Al2O3-SiO2 system
• الوصول للمادة أونلاين: http://repository.vnu.edu.vn/handle/VNU_123/68355; https//doi.org/ 10.25073/2588-1124/vnumap.4362

The paper presents research results of structure of the Mullite system (3Al2O3.2SiO2) by Molecular Dynamics simulation (MDs) using the Born–Mayer– Huggins pair interaction and periodic boundary conditions. The simulation is performed with model of 5250 atoms at different pressure and at 3500 K temp...