507 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- University of FreiburgDE49 papers
- Karlsruhe Institute of TechnologyDE19 papers
- Forschungszentrum JülichDE5 papers
- Johns Hopkins UniversityUS4 papers
- Technische Universität DarmstadtDE4 papers
- University of CambridgeGB4 papers
- Fraunhofer Institute for Industrial MathematicsDE3 papers
- RWTH Aachen UniversityDE3 papers
- University of RegensburgDE3 papers
- Arizona State UniversityUS2 papers
- Fraunhofer Institute for Applied Solid State PhysicsDE2 papers
- Innovation Cluster (Canada)CA2 papers
7 papers · 1 filter
An All-Atom Force Field for Dry and Water-Lubricated Carbon Tribological Interfaces
Thomas Reichenbach, Severin Sylla, Leonhard Mayrhofer +4
We present a non-reactive force field for molecular dynamics simulations of interfaces between passivated amorphous surfaces and their interaction with water. The force field enabl…
Melting, bubble-like expansion and explosion of superheated plasmonic nanoparticles
Simon Dold, Thomas Reichenbach, Alessandro Colombo +32
We report on time-resolved coherent diffraction imaging of gas-phase silver nanoparticles, strongly heated via their plasmon resonance. The x-ray diffraction images reveal a broad…
First-principles analysis of the interplay between electronic structure and volume change in colquiriite compounds during Li intercalation
A. F. Baumann, D. Mutter, D. F. Urban +1
A main source of capacity fading in lithium-ion batteries is the degradation of the active cathode materials caused by the series of volume changes during charge and discharge cycl…
Sound waves, diffusive transport, and wall slip in nanoconfined compressible fluids
Hannes Holey, Peter Gumbsch, Lars Pastewka
Although continuum theories have been proven quite robust to describe confined fluid flow at molecular length scales, molecular dynamics (MD) simulations reveal mechanistic insight…
Studying Evolutionary Solution Adaption Using a Flexibility Benchmark Based on a Metal Cutting Process
Leo Francoso Dal Piccol Sotto, Sebastian Mayer, Hemanth Janarthanam +2
We consider optimizing for different production requirements from the viewpoint of a bio-inspired framework for system flexibility that allows us to study the ability of an algorit…
Atomic resolution mapping of localized phonon modes at grain boundaries
Benedikt Haas, Tara M. Boland, Christian Elsässer +5
Phonon scattering at grain boundaries (GBs) is significant in controlling nanoscale device thermal conductivity. However, GBs could also act as waveguides for selected modes. To me…
Yielding under compression and the polyamorphic transition in silicon
Jan Grießer, Gianpietro Moras, Lars Pastewka
We investigate the behavior of amorphous silicon under hydrostatic compression using molecular simulations. During compression, amorphous silicon undergoes a discontinuous nonequil…