Classical molecular dynamics simulation is used for structural thermodynamic and dynamic analysis of Au-Pd bimetallic clusters. It is observed that the Pd-core/Au-shell structure is the most stable, and can be formed through annealing of other structures such as Au-core/Pd-shell, eutecticlike, or solid solution. Depending on the starting temperature and initial composition, three-layer icosahed...

Computer calculations were carried out to determine the reaction rates and the mean structure of bimetallic nanoparticles prepared via a microemulsion route. The rates of reaction of each metal were calculated for a particular microemulsion composition (fixed intermicellar exchange rate) and varying reduction rate ratios between both metal and metal salt concentration inside the micelles. Model...

A series of ZrO2 supported Ru-Co bimetallic catalysts were prepared and evaluated for the hydrogenolysis of glycerol. The Ru-Co/ZrO2 bimetallic catalyst combines the advantages of both Ru and Co, exhibiting high activity and good selectivity to 1,2-propanediol. The X-ray diffraction (XRD) and TEM results show that higher calcination temperature leads to lower reducibility of cobalt oxides and l...

We present a detailed analysis of the structural and magnetic properties of solution-grown PtCo-CdS hybrid structures in comparison to similar free-standing PtCo alloy nanoparticles. X-ray absorption spectroscopy is utilized as a sensitive probe for identifying subtle differences in the structure of the hybrid materials. We found that the growth of bimetallic tips on a CdS nanorod substrate lea...

Bimetallic homonuclear iron(II) and ruthenium(II) N-heterocyclic carbene complexes have been synthesized and crystallographically analyzed. As a spacer ligand for interconnecting the two redox-active metal centers, a ditopic carbene ligand has been used that comprises two carbene sites annelated to benzene. Detailed electrochemical and spectroelectrochemical analyses of the bimetallic systems r...

The influence of hydrazine reduction on metal dispersion, particle size distribution, and support morphology was investigated for a series of bimetallic Ru-AuiMgO catalysts. The catalysts were prepared by impregnation of MgO with chlorine-containing precursor salt solutions. Hydrazine reduction significantly lowered the residual chlorine content of the catalysts and allowed the formation of hig...

Density functional theory (DFT)-based calculations were carried out to predict the geometry, energy and electronic structures of the small bimetallic AumPtn (2 ≤m + n≤ 4) clusters deposited on a single-wall (5,5)-carbon nanotube (CNT). The chemical reactivity of these supported bimetallic clusters towards O2 reduction reaction was also considered. The calculations indicate that Au atoms tend to...

Self-propulsion and directed movement of nanoand micro-particles can in principle provide novel components for applications in microrobotics and MEMS. Our research involves the design of catalytic propulsion systems and the control of colloidal movement based on this principle. We have designed autonomous nanomotors that mimic biological motors by using catalytic reactions to generate forces de...

Herein, the generation of gold, silver, and silver-gold (Ag-Au) bimetallic nanoparticles was carried out in collagen (gelatin) solution. It first showed that the major ingredient in gelatin polypeptide, glutamic acid, acted as reducing agent to biomimetically synthesize noble metal nanoparticles at 80°C. The size of nanoparticles can be controlled not only by the mass ratio of gelatin to gold i...

We use density functional theory (DFT) to study CO-adsorption-induced Pd surface segregation in Au/Pd bimetallic surfaces, dynamics of Pd−Au swapping, effect of defects on the swapping rate, CO-induced Pd clustering, and the reaction mechanism of CO oxidation. The strong COphilic nature of Pd atoms supplies a driving force for the preferential surface segregation of Pd atoms and Pd cluster form...