Predicting Atomic Charges in MOFs by Topological Charge Equilibration
Advanced Functional Materials, EarlyView.An atomic charge prediction method is presented that is able to accurately reproduce ab‐initio‐derived reference charges for a large number of metal–organic frameworks. Based on a topological charge equilibration scheme, static charges that fulfill overall neutrality are quickly generated.
Babak Farhadi Jahromi +2 more
wiley +1 more source
Magnetic-field controlled on-off switchable non-reciprocal negative refractive index in non-Hermitian photon-magnon hybrid systems. [PDF]
Nat CommunKim J, Kim B, Kim B, Jeon H, Kim SK.
europepmc +1 more source
Advanced Functional Materials, EarlyView.A novel approach for the design of functional semiconductors is presented, which utilizes the excellent optoelectronic properties of layered hybrid perovskites and the possibility to introduce a molecular photoswitch as the organic spacer. This concept is successfully demonstrated on a coumarin‐based system with the possibility to change the bandgap ...
Oliver Treske +4 more
wiley +1 more source
Advanced Functional Materials, EarlyView.This study presents a versatile approach to harnessing miscible aqueous domains, enabling liquid‐in‐liquid compartmentalization using a barrier formed in situ rather than bulk immiscibility. The barrier forms upon the complexation of multifunctional nanoparticles and ligands at the contact boundary of aqueous phases.
Seyyed Alireza Hashemi +7 more
wiley +1 more source
Novel techniques to analyze dynamical properties of quantum chaos with peculiar evidence of hybrid systems confinement. [PDF]
Sci RepBary G +4 more
europepmc +1 more source
Digital Actuation Control of Soft Robotic Origami With Self‐Folding Liquid Crystal Elastomer Hinges
Advanced Functional Materials, EarlyView.Self‐folding soft‐rigid hybrid robotic origami is enabled by liquid crystal elastomer actuators with embedded Joule heating and closed‐loop digital control. Digitally addressable hinges provide reversible and programmable transitions between distinct folded states while maintaining actuation performance at high cycle counts (over 1500).
David C. Bershadsky +3 more
wiley +1 more source
Coexistence of Redox-Active Metal and Ligand Sites in Copper-Based Two-Dimensional Conjugated Metal-Organic Frameworks as Active Materials for Battery-Supercapacitor Hybrid Systems. [PDF]
ChemSusChemBagheri A +16 more
europepmc +1 more source
Advanced Functional Materials, EarlyView.Permanent magnets derive their extraordinary strength from deep, universal electronic‐structure principles that control magnetization, anisotropy, and intrinsic performance. This work uncovers those governing rules, examines modern modeling and AI‐driven discovery methods, identifies critical bottlenecks, and reveals electronic fingerprints shared ...
Prashant Singh
wiley +1 more source
Correction: Ortelli et al. Design of TiO2-Based Hybrid Systems with Multifunctional Properties. Molecules 2023, 28, 1863. [PDF]
MoleculesOrtelli S +9 more
europepmc +1 more source