AMS 01 02 Atomistic modelling of the Fe-C system
AMS 12 01 Development of analytic bond-order potentials for the simulation of complex intermetallic phases
AMS 12 02 Atomistic simulation of the kinetics of tcp formation
AMS 13 01 Charge transfer in the atomistic simulation of carbide and nitride nanocomposite coatings
AMS 13 02 Development and application of bond-order potentials for SiC-TiC nanocomposite coatings
DFG VA205/3 2 Static and dynamic critical phenomenaAlthough critical phenomena have widely been investigated in the literature, almost all these studies consider the case of energy conserving systems. In particular, –to the best of our knowledge- no... Continue reading "Static and dynamic critical phenomena"
EXT 08 02 Modelling of pine-tree nanowiresRainer SchulzRobert Spatschek Max-Planck Institute for Iron Research, Düsseldorf Nanowires are thin wires (e.g. metal) which are severely restricted in 2 dimensions of space and show a one-dimensional... Continue reading "Modelling of pine-tree nanowires"
LWW 03 01 Functional and structural fatigue of shape memory alloys
MMM 02 02 Grain boundaries in polycrystals: Bridging the scales
MMM 06 01 Brittle-to-ductile transition in tungsten single and polycrystals: Microstructure and failure mechanisms
MMM 15 01 Micromechanical modelling of fatigue lifetimes in bearing steels
STKS 02 01 Void drag model for Grain GrowthMulti-phase field (MPF) and molecular dynamics (MD) simulations have been applied to study nanograin growth mechanisms. At mesoscale level, prominent properties of nanostructured materials, e.g. the grain... Continue reading "Void drag model for Grain Growth"
STKS 03 01 Plastic effects on the kinetics of phase transformations
STKS 03 02 Gibbs free energy with elasticity
STKS 04 01 Multiscale simulation of metal-polymer hybrid materials
STKS 05 01 Phase field modelling of large deformationsDuring simulation of phase transformations large lattice parameter changes (i.e. eigenstrains) might occur. The standard linear elasticity which is typically used in phase field simulations proved to be... Continue reading "Phase field modelling of large deformations"
STKS 08 02 Secondary-phase particle drag and pinningSecondary-phase particles are frequently observed in different alloys: light elements, e.g. carbon, boron, nitrogen and oxygen within multicomponent alloys may convert to carbides, borides, nitrides and... Continue reading "Secondary-phase particle drag and pinning"
STKS 09 01 Phase-field simulation of diffusion couplesLinking thermodynamic and atomic mobility databases with two-dimensional phase-field simulation, the evolution of interdiffusion microstructures in a series of Ni–Al diffusion couples associated with... Continue reading "Phase-field simulation of diffusion couples"
STKS 09 02 Thermodynamics and interdiffusion at interfaces with a potential jump
STKS 17 01 Solid-State and Viscous SinteringThe project aims on reaching a qualitative understanding about the principal mechanisms of sintering, their relative importance and the feasibility of numerical treatments..Continue reading "Solid-State and Viscous Sintering"
STKS 18 02 Kinetics of batteries and related systemsDespite the exciting developments in the field of lithium ion batteries as energy storage devices, there are severe issues restricting their capacity and cycleability, arising e.g. from volume expansion... Continue reading "Kinetics of batteries and related systems"