ICAMS / Interdisciplinary Centre for Advanced Materials Simulation
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Ab initio simulation of diffusion and segregation of alloying elements in the γ/γ’-microstructure of superalloys

Date: 12.05.2016
Place: 8th Interaction Week of the SFB/Transregio 103 Superalloy Single Crystals, Fürth, Germany

Maximilian Grabowski
Sergej Schuwalow
Jutta Rogal
Ralf Drautz

The scientific objective of project C2 is the ab initio description of fundamental diffusion processes and segregation behavior of alloying elements within the γ/γ’-microstructure of Ni- and Co-base alloys. This includes the calculation of diffusion coefficients and investigation of specific diffusion mechanisms as well as the development of methods to comprehensively treat the complex interplay of diffusion, chemical composition and strain accumulation within these systems.

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