an analytical study was performed to study effects of thermo-diffusion and chemical reactions on a three-dimensional mhd mixed convective flow of dissipative fluid along an infinite vertical porous plate with transverse sinusoidal suction velocity. the parabolic partial differential equations governing the fluid flow, heat transfer, and mass transfer were solved using perturbation technique and...

Hydrogen Evolution Reaction In article number 2300961, Dominik Eder and co-workers test a visible light responsive titanium-based metal-organic framework (MOF) comprised of 2D secondary building units for the hydrogen evolution reaction. It ranks amongst highest performing MOFs this challenging conversion. Upon photoexcitation, unique structure enables efficient charge separation extraction, di...

As a process complementing conventional electrode reactions, ionic vacancy production in electrode reaction was theoretically examined; whether reaction is anodic or cathodic, based on the momentum conservation by Newton's second law of motion, electron transfer necessarily leads to the emission of original embryo vacancies, and dielectric polarization endows to them the same electric charge as...

Proton and deuteron transfer rates and mechanisms are studied in polar molecular nanoclusters. The cluster environment strongly influences the reaction rate and the nature of these changes is studied as a function of the cluster size. The stabilities of the covalent reactant and polar product states change with cluster size and this effect alters both the equilibrium properties and transfer rat...

In this review we discuss structure-function relationships of the core complex of photosystem II, as uncovered from analysis of optical spectra of the complex and its subunits. Based on descriptions of optical difference spectra including site directed mutagenesis we propose a revision of the multimer model of the symmetrically arranged reaction center pigments, described by an asymmetric excit...

The application of a rotating cathode in a river sediment microbial fuel cell increased the oxygen availability to the cathode, and therefore improved the cathode reaction rate, resulting in a higher power production (49 mW/m(2)) compared to a nonrotating cathode system (29 mW/m(2)). The increased dissolved oxygen in the water of our lab-scale sediment MFC, however, resulted in a less negative ...

Trinuclear rare-earth-metal methylidene (CH2 2−) complexes are an emerging class of compounds that serve as methylidene transfer agents for methylenation of carbonyl compounds. Herein, the reaction of a trinuclear scandium methylidene complex with acetophenone was used as a model reaction of the multimetallic-cooperating methylidene transfer case, and its detailed mechanism has been investigate...

We model the energy transfer and trapping kinetics in PSI. Rather than simply applying Förster theory, we develop a new approach to self-consistently describe energy transfer in a complex with heterogeneous couplings. Experimentally determined spectral densities are employed to calculate the energy transfer rates. The absorption spectrum and fluorescence decay time components of the complex at ...

In this work, by using density functional theory, the adsorption of Nitramide (NH2NO2) molecule on the surface of pristine, B, As and B&As doped (4,4) armchair aluminum nitride nanotube (AlNNTs) is investigated. From optimized structures the adsorption energy, deformation energy, natural bond orbital (NBO), atom in molecule (AIM), quantum parameters, reduced density gradient (RDG) and molecular...