Noncovalent CH-π and π-π Interactions in Phosphoramidite Palladium(II) Complexes with Strong Conformational Preference. [PDF]
Angew Chem Int Ed Engl, 2021 Žabka M, Naviri L, Gschwind RM.
europepmc +1 more source
New AI‐Assisted Approach for Expanding the Solution Space: Application to Lattice Structure Design
Advanced Engineering Materials, EarlyView.This work introduces an innovative framework for designing structured materials by ex panding the design space through reparameterization of qualitative variables into continuous structural descriptors. Combined with machine‐learning‐based prediction and multi‐objective optimization, the approach enables the discovery of novel lattice architectures ...
G. H. Gahimbare +5 more
wiley +1 more source
Journal of MateriomicsBoron nitride nanoflakes (BNNF) are rendered as ideal thermal conductivity fillers for thermal interface materials (TIMs) due to their ultrahigh thermal conductivity (TC) and superior electronic insulation.
Mingming Sheng +9 more
doaj +1 more source
Aromatic Polyphenol π-π Interactions with Superoxide Radicals Contribute to Radical Scavenging and Can Make Polyphenols Mimic Superoxide Dismutase Activity. [PDF]
Curr Issues Mol Biol, 2022 Caruso F +5 more
europepmc +1 more source
High‐Resolution Corrosion Fingerprinting of Alloy Libraries via Microdroplet Spectroelectrochemistry
Advanced Engineering Materials, EarlyView.Ionic‐liquid microdroplet spectroelectrochemistry enables stable, localized electrochemical measurements over extended timescales. By coupling impedance spectroscopy, wetting analysis, finite‐element simulations, and operando Raman spectroscopy, it disentangles geometrical and electrochemical effects, opening new opportunities for rapid corrosion ...
Ekaterina Kurchavova +3 more
wiley +1 more source
Mechanochemical Preparation of Dipyridyl-Naphthalenediimide Cocrystals: Relative Role of Halogen-Bond and π-π Interactions. [PDF]
Cryst Growth Des, 2021 Mazzeo PP +4 more
europepmc +1 more source
Advanced Engineering Materials, EarlyView.Schematic representation of modes of microcrack nucleation, growth and temporary arrestment at different boundaries, with the criteria for crack propagation in three scenarios: (1) large notch, (2) defect/small sharp notch, and (3) long crack. This work revisits and integrates results on the fatigue behavior of advanced bainitic steels (in particular ...
Lucia Morales‐Rivas
wiley +1 more source
Synergistic effect of hydrogen bonds and π-π interactions of B(C6F5)3·H2O/amides complex: Application in photoredox catalysis. [PDF]
iScience, 2023 Wang SJ, Wang L, Tang XY.
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Entropy‐Driven Design of Low‐Melting‐Point Alloys via Compositionally Complex Strategy
Advanced Engineering Materials, EarlyView.Conventional low‐melting‐point alloys (LMPAs) are limited by a narrow compositional space and inherent property trade‐offs. This review presents an entropy‐driven design strategy that overcomes these limitations, ushering in a new class of low‐melting‐point compositionally complex alloys (LMCCAs).
Yinghui Shang +6 more
wiley +1 more source
A Quantum Chemical Deep-Dive into the π-π Interactions of 3-Methylindole and Its Halogenated Derivatives-Towards an Improved Ligand Design and Tryptophan Stacking. [PDF]
Pharmaceuticals (Basel), 2022 Van Lommel R +5 more
europepmc +1 more source