Results 231 to 240 of about 2,166,508 (336)
Predicting Atomic Charges in MOFs by Topological Charge Equilibration
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
Forecasting auditor's going concern opinion using with hybrid robust machine learning model. [PDF]
Ejder U, Yaşar A.
europepmc +1 more source
Encoding Magnetic Anisotropies in Digital Light Processing 3D Printing
A hybrid magnetic device—combining a coaxial coil within a nested Halbach array—is presented, integrated into a DLP 3D printer to enable spatially resolved magnetic field control. This system enables complex, multimodal responses by programming liquid crystal elastomer resins for magnetic and thermal actuation, and by inducing electrically conductive ...
Eléonore Aïdonidis +11 more
wiley +1 more source
Chiral SURMOFs for Vibrational Circular Dichroism: Multiscale Modeling and Experimental Insights
The use of solid‐state vibrational circular dichroism (VCD) for MOFs is still somewhat unexplored, and in this work, it is shown that chiral surface‐anchored MOFs (SURMOFs) grown on CaF2 provide an excellent platform for VCD. Experimental results are validated through multiscale modeling, showing strong agreement across multiple spectroscopic ...
Ana C. Fingolo +9 more
wiley +1 more source
Hybrid type 1 effectiveness-implementation studies: why and how to do them. [PDF]
Baloh J, Landes SJ, Smith JL, Curran GM.
europepmc +1 more source
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
An adaptive hybrid quadrature scheme: Combining Simpson's rule and Gaussian quadrature for enhanced numerical integration. [PDF]
Asgedom AA, Kefela YY.
europepmc +1 more source
SYSTEM CREATING OF HYBRID METHODS OF MATHEMATICAL MODELING OF DIFFICULT ELECTRODYNAMICS SYSTEMS
M.A. Buzova, S.A. Bukashkin, M.A. Minkin
openalex +2 more sources
Upcycling of Disposable Face Masks into Water‐Resistant and Flame Retardant Foams
Disposable mask waste is upcycled into lightweight polypropylene‐based foams with tunable porosity and composite architectures reinforced by ear‐loop fibers. The sustainable solvent‐based process enables upcycling rates of 91% and solvent recovery of >90%.
Jingjing Pan +3 more
wiley +1 more source

