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75 papers · 1 filter
Data-driven stochastic 3D modeling of the nanoporous binder-conductive additive phase in battery cathodes
Phillip Gräfensteiner, Markus Osenberg, André Hilger +5
A stochastic 3D modeling approach for the nanoporous binder-conductive additive phase in hierarchically structured cathodes of lithium-ion batteries is presented. The binder-conduc…
Effect of crystallographic twins on the elastoplastic response of polycrystals
Lucas Monteiro Fernandes, Philipp Rieder, Matthias Neumann +4
We investigate the influence of crystallographic twins on the elastoplastic response of -TiAl intermetallics via full-field FFT-based computations. We first introduce a hierarch…
Virtual reassembling of 3D fragments for the data-driven analysis of fracture mechanisms in composite materials
Thomas Wilhelm, Trang Thu Võ, Orkun Furat +2
This paper introduces a novel method for characterizing fracture mechanisms in composite materials using 3D image data gained by computed tomography (CT) measurements. In mineral l…
The relevance of structural variability in the time-domain for computational reflection anisotropy spectroscopy at solid-liquid interfaces
Justus Leist, Jongmin Kim, Holger Euchner +1
In electrochemistry, reactions and charge-transfer are to a large extent determined by the atomistic structure of the solid-liquid interface. Yet due to the presence of the liquid…
An AFM-based approach for quantification of guest particle deformation during mechano-fusion
Phillip Gräfensteiner, Judith Friebel, Lisa Ditscherlein +3
During the mechano-fusion process for dry particle coating, (hetero)-aggregates are formed consisting of host particles which are coated by smaller guest particles. During this pro…
Group theoretical and ab-initio description of color center candidates in fluorographene
M. S. Tacca, M. B. Plenio
We present a group theoretical and ab-initio analysis of lattice point defects in fluorographene, with a focus on neutral and negative vacancies. By using a…