Roters, F.; Diehl, M.; Shanthraj, P.: On the importance of using 3D microstructures in Crystal Plasticity Simulations. Symposium: 3D materials characterization at all length scales and its applications to iron and steel, Düsseldorf, Germany (2017)
Roters, F.; Kok, P.: An integrated approach on microstructure, damage and texture modelling of modern steels. 5th International Conference on Steels in Cars and Trucks, SCT 2017
, Amsterdam, The Netherlands (2017)
Liu, C.; Diehl, M.; Shanthraj, P.; Roters, F.; Raabe, D.; Sandlöbes, S.; Dong, J.: An integrated crystal plasticity-phase field approach to locally predict twin formation in magnesium. DGM Meeting, "Herausforderungen bei der skalenübergreifenden Modellierung von Werkstoffen ", Regensburg, Germany (2017)
Roters, F.; Wong, S. L.; Shanthraj, P.; Diehl, M.; Raabe, D.: Thermo mechanically coupled simulation of high manganese TRIP/TWIP Steel. 5th International Conference on Material Modeling, ICMM 5, Rome, Italy (2017)
Roters, F.; Bambach, M.; Wong, S. L.: Development of dislocation density based constitutive models ? the parameter dilemma. GAMM 2017, 88th Annual Meeting of the International Association of Applied Mathematics and Mechanics
, Weimar, Germany (2017)
Diehl, M.; Cereceda, D.; Wong, S. L.; Reuber, J. C.; Roters, F.; Raabe, D.: From Phenomenological Descriptions to Physics-based Constitutive Models EPSRC Workshop on Multiscale Mechanics of Deformation and Failure in Materials. EPSRC Workshop on Multiscale Mechanics of Deformation and Failure in Materials
, Aberdeen, Scotland (2016)
Oxides find broad applications as catalysts or in electronic components, however are generally brittle materials where dislocations are difficult to activate in the covalent rigid lattice. Here, the link between plasticity and fracture is critical for wide-scale application of functional oxide materials.
In this project we conduct together with Dr. Sandlöbes at RWTH Aachen and the department of Prof. Neugebauer ab initio calculations for designing new Mg – Li alloys. Ab initio calculations can accurately predict basic structural, mechanical, and functional properties using only the atomic composition as a basis.