Structure-Enhanced Stress Attenuation in Magnetically Tunable Microstructures: A Numerical Study of Engineered BCT Lattices. [PDF]
Feng KP, Liang CC, Li YH.
europepmc +1 more source
This study investigates the effects of milling parameters, including rotational speed, milling duration, and ball‐to‐powder ratio, on TiAl particle size and morphology in an XHV‐equivalent atmosphere. The creation of oxide‐free surfaces enhances the mechanical properties of green bodies.
Jytte Möckelmann +4 more
wiley +1 more source
Crystal structure of 3-hydroxypropionyl-CoA synthetase (ADP-forming) from <i>Nitrosopumilus maritimus</i>. [PDF]
Johnson J +9 more
europepmc +1 more source
A Lightweight Procedural Layer for Hybrid Experimental–Computational Workflows in Materials Science
We unveil a prototype hybrid‐workflow framework that fuses automatedcomputation with hands‐on experiments. Built atop pyiron, a lightweight, parameterized layer translates procedure descriptions into executable manual steps, syncing instrument settings, human interventions, and data capture in real‐time today.
Steffen Brinckmann +8 more
wiley +1 more source
Structural and dynamic insights into agonist recognition and function of the thromboxane A<sub>2</sub> receptor. [PDF]
Krawinski P +11 more
europepmc +1 more source
Optimization of the Production of Rubber Compounds Using Mathematical Models
Rubber compounds were mixed in a batch internal mixer, and symbolic regression was used to derive mathematical models linking recipe and process parameters to ram path, torque, and mixing quality (incorporation, dispersion, distribution). Subsequent optimization with evolutionary algorithms identified operating conditions that reduce specific energy ...
Anke Bardehle +7 more
wiley +1 more source
Probing Solution Dynamics of Tissue Factor Using Molecular Dynamics Simulations Guided by NMR Chemical Shifts. [PDF]
Lihan M +4 more
europepmc +1 more source
Analyzing Electronic Excitations and Exciton Binding Energies in Y6 Films
The Y6 molecule is used for increasing the efficiency of organic solar cells. The exciton binding energy is calculated for ensembles of Y6 molecules that are representative of the typically used films. The calculations show that the excitons typically spread out over many molecules.
Sahar Javaid Akram +2 more
wiley +1 more source
Quantum refinement with electron diffraction and X-ray free-electron laser data: comparative study of ribonucleotide reductase dimetal site. [PDF]
Lundgren KJM +9 more
europepmc +1 more source

