Electrochemical experiments reveal what happens, whereas first principles calculations explain why. Emerging computational electrochemistry is bridging these perspectives, enabling quantitative understanding of electrode/electrolyte interfaces and enabling the rational design of next‐generation energy storage materials.
Kenji Oqmhula, Ryo Maezono, Kenta Hongo
wiley +1 more source
Wave propagation in a photo-thermomechanical medium with triple porosity and voids under the Lord-Shulman theory. [PDF]
Moulahi T +3 more
europepmc +1 more source
Arbitrary Wavefront Manipulation in Real Space and Momentum Space Based on Elliptical Structures
Leveraging elliptical structures—while preserving real space arbitrary wavefront manipulation—we generalize the manipulation to momentum space rather than only sustaining topological singularities. Multifunctional integrated outputs, such as beam deflection and focusing, can be flexibly achieved in the near–infrared communication band, and the ...
Siqi Chang +4 more
wiley +1 more source
Tensile effects in peridynamic plates with circular holes. [PDF]
Damian S +4 more
europepmc +1 more source
Coupled fractional-order, rotational, and hall current effects on deformation in a magneto-micropolar thermoviscoelastic half-space. [PDF]
Jaradat EK +5 more
europepmc +1 more source
Wave propagation and thermal behavior in nonlocal thermoelastic porous media under moving heat sources with three-phase-lag and Green-Naghdi models. [PDF]
Othman MIA, Said SM, Gamal EM.
europepmc +1 more source
The transition from cryogenic distillation to polymeric sorbents for light hydrocarbon purification is crucial for energy and environmental sustainability. The polymeric sorbents are engineered to separate gas mixtures based on their specific properties.
Kelechi Festus +9 more
wiley +1 more source
Bulk Boundary Condition for Semi-Infinite Surfaces in Density Functional Theory. [PDF]
Bhowmik S, Medford AJ, Suryanarayana P.
europepmc +1 more source
Engineering Metal‐Pocket Cooperativity in Single‐Atom COF Nanozymes for Selective Cascade Catalysis
A multilevel programming strategy is developed to engineer single‐atom COF nanozymes with tunable metal centers and chiral pockets inspired by heme–pocket cooperativity. This approach enables controlled metal–pocket interplay for asymmetric cascade catalysis, delivering high activity, selectivity, and recyclability in an asymmetric oxidation–aldol ...
Ziping Li +7 more
wiley +1 more source
The Electrosolvation Effect: The Medium Is the Message. [PDF]
Wang S +4 more
europepmc +1 more source

