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Simulation of diffusion along grain boundaries
Investigator: RNDr. Jiří Čermák, CSc., DSc.
Number of Project: OC P3.110
Agency: Ministry of Education, Youth and Sports
Duration: 01. 01. 1999 - 31. 12. 2001
The aim of the project is to contribute to better understanding of grain boundary diffusion mechanisms. The main attention will be paid to atomic movement along grain boundaries in modified Ni - Al intermetallics. An influence of segregated atoms upon the energetics of grain boundary diffusion will be taken into consideration.
Publications:
J. Čermák: Energy of Vacancy Formation and Migration by Two Σ5 Tilt Grain Boundaries in Ni3Al Intermetallic: A MC Simulation Study. Def. Dif. For. 203-205, 2002, 161.
J. Čermák: Vacancies by Selected Special Tilt Grain Boundaries in Ni3Al, Comput. Mater. Sci. 25, 2002, 606.
J. Čermák: Chemical Composition of (310)[100] Symmetrical Tilt Grain Boundary in Ni3Al. 3th International Conference on Materials Structure and Micromechanics of Fracture, Brno, Czech Republic, June 27-29 2001.
J. Čermák: Interaction of Vacancy with Chosen Special Tilt Grain Boundaries - Monte Carlo Simulation. METAL 2001 - 10th International Metallurgical & Material Conference, Ostrava, Czech Republic, May 15-17 2001, CD-ROM.
Last update
11. 11. 2009